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3-Amino-1-N-alloc-piperidine

CAT: 0127-OR964532-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR964532-01Size:250 mg
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CAS Number
886363-44-6
MDL Number
MFCD03839997
Purity
95%
Smiles
NC1CCCN(C1)C(=O)OCC=C

Chemical Information

Prop-2-enyl 3-aminopiperidine-1-carboxylate

3-amino-1-N-alloc-piperidine is an aminopiperidine that is piperidin-3-amine substituted by a [(prop-2-en-1-yl)oxy]carbonyl group at position 1. It is a carbamate ester, an aminopiperidine, a piperidinecarboxylate ester and an olefinic compound.

CAS Number886363-44-6
PubChem CID24797350
IUPAC Nameprop-2-enyl 3-aminopiperidine-1-carboxylate
Molecular FormulaC9H16N2O2
Molecular Weight184.24
XLogP0.4
Topological Polar Surface Area55.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity194
SMILES
C=CCOC(=O)N1CCCC(C1)N
InChI
InChI=1S/C9H16N2O2/c1-2-6-13-9(12)11-5-3-4-8(10)7-11/h2,8H,1,3-7,10H2
InChIKey
YNKZAYMCRFZUNL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Prop-2-enyl 3-aminopiperidine-1-carboxylate
CAS: 886363-44-6
CID: 24797350
Formula: C9H16N2O2
MW: 184.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight184.24
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass184.121177757
Monoisotopic Mass184.121177757
Topological Polar Surface Area55.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity194
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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LKB36344-013-Amino-1-N-alloc-piperidine
sc-3225973-N-Alloc-Amino-azepan-2-one
sc-2606723-Amino-1-N-Cbz-piperidine
sc-2667663-N-Boc-amino piperidine
sc-2667953-N-Cbz-amino-piperidine
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sc-2664283-Amino-1-N-Fmoc-piperidine hydrochloride
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sc-272412(S) -3-N-Cbz-amino-piperidine

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