1-cyclopropyl-N,3-dimethylbutan-2-amine

C9H19N — CID 64903822

IUPAC1-cyclopropyl-N,3-dimethylbutan-2-amine
SMILESCNC(CC1CC1)C(C)C
InChIInChI=1S/C9H19N/c1-7(2)9(10-3)6-8-4-5-8/h7-10H,4-6H2,1-3H3
InChIKeyOBWUKAOAMULMNX-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.03
Rot. Bonds4

About 1-cyclopropyl-N,3-dimethylbutan-2-amine

1-cyclopropyl-N,3-dimethylbutan-2-amine (PubChem CID 64903822) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is 1-cyclopropyl-N,3-dimethylbutan-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N,3-dimethylbutan-2-amine
PubChem CID64903822
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name1-cyclopropyl-N,3-dimethylbutan-2-amine
SMILESCNC(CC1CC1)C(C)C
InChIInChI=1S/C9H19N/c1-7(2)9(10-3)6-8-4-5-8/h7-10H,4-6H2,1-3H3
InChIKeyOBWUKAOAMULMNX-UHFFFAOYSA-N
XLogP2.03
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-cyclopropyl-N,3-dimethylbutan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-1-cyclohexyl-N,3-dimethylbutan-2-amine
CID 167019095
3-cyclohexyl-1,1-difluoro-N-methylpropan-2-amine
CID 80604795
1-cycloheptyl-N,3-dimethylhexan-2-amine
CID 107893929
1-cyclobutyl-N-methyl-3-methylsulfonylbutan-2-amine
CID 115863751
[(2R)-2,3-dimethylbutyl]cyclopropane
CID 58368146
4-cyclopropyl-3-fluoro-N-methylbutan-2-amine
CID 105428850
3-methoxy-N-methyl-1-(oxan-4-yl)butan-2-amine
CID 79617524
1-cyclobutyl-3-methoxy-N,4,4-trimethylpentan-2-amine
CID 116724473
3-(cyclopentylmethyl)-N,4-dimethylpentan-2-amine
CID 62915823
(1-cyclopentyl-3,4-dimethylpentan-2-yl)hydrazine
CID 105299129
(5S)-N-(1-cyclohexyl-3-methylbutan-2-yl)-2,4,7-trimethyl-5-(methylamino)octanamide
CID 142241058
N-methyl-1-[4-(2-methylpropyl)cyclohexyl]methanamine
CID 155019686

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N,3-dimethylbutan-2-amine?
The IUPAC name of 1-cyclopropyl-N,3-dimethylbutan-2-amine (CID 64903822) is 1-cyclopropyl-N,3-dimethylbutan-2-amine.
What is the SMILES notation for 1-cyclopropyl-N,3-dimethylbutan-2-amine?
The canonical SMILES for 1-cyclopropyl-N,3-dimethylbutan-2-amine is CNC(CC1CC1)C(C)C.
What is the InChIKey of 1-cyclopropyl-N,3-dimethylbutan-2-amine?
The InChIKey is OBWUKAOAMULMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-7(2)9(10-3)6-8-4-5-8/h7-10H,4-6H2,1-3H3.
What are the key properties of 1-cyclopropyl-N,3-dimethylbutan-2-amine?
1-cyclopropyl-N,3-dimethylbutan-2-amine has a molecular weight of 141.26 g/mol, XLogP of 2.03, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N,3-dimethylbutan-2-amine is sourced from PubChem (CID 64903822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).