MS049

CAT: 0926-CKC81623-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0926-CKC81623-02Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1502816-23-0

MDL Number

MFCD30489737

Smiles

CNCCN1CCC (CC1) OCC2=CC=CC=C2

Molecular Formula

C15H24N2O

Molecular Weight

248.36 g/mol

Controlled

Chemical Information

2-(4-(Benzyloxy)piperidin-1-yl)-N-methylethanamine

CAS Number	1502816-23-0
PubChem CID	53868701
IUPAC Name	N-methyl-2-(4-phenylmethoxypiperidin-1-yl)ethanamine
Molecular Formula	C15H24N2O
Molecular Weight	248.36
XLogP	1.7
Topological Polar Surface Area	24.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	18
Formal Charge	0
Complexity	209

SMILES

CNCCN1CCC(CC1)OCC2=CC=CC=C2

InChI

InChI=1S/C15H24N2O/c1-16-9-12-17-10-7-15(8-11-17)18-13-14-5-3-2-4-6-14/h2-6,15-16H,7-13H2,1H3

InChIKey

HBOJWAYLSJLULG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1502816-23-0

CID: 53868701

Formula: C15H24N2O

MW: 248.36

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	248.36
XLogP3	1.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	248.188863393
Monoisotopic Mass	248.188863393
Topological Polar Surface Area	24.5 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	209
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes