N-Methyl cyclobutaneethanamine

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CAS Number

1365939-73-6

MDL Number

MFCD21240995

Purity

=95%

Smiles

CNCCC1CCC1

Chemical Information

(2-Cyclobutylethyl)(methyl)amine

CAS Number	1365939-73-6
PubChem CID	59303437
IUPAC Name	2-cyclobutyl-N-methylethanamine
Molecular Formula	C7H15N
Molecular Weight	113.20
XLogP	1.8
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	8
Formal Charge	0
Complexity	57

SMILES

CNCCC1CCC1

InChI

InChI=1S/C7H15N/c1-8-6-5-7-3-2-4-7/h7-8H,2-6H2,1H3

InChIKey

HCTZDKQWRNKPMT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1365939-73-6

CID: 59303437

Formula: C7H15N

MW: 113.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	113.20
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	113.120449483
Monoisotopic Mass	113.120449483
Topological Polar Surface Area	12 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	57.4
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

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