3-methyl-3-azabicyclo[4.1.0]heptan-1-amine

C7H14N2 — CID 82651001

IUPAC3-methyl-3-azabicyclo[4.1.0]heptan-1-amine
SMILESCN1CCC2CC2(N)C1
InChIInChI=1S/C7H14N2/c1-9-3-2-6-4-7(6,8)5-9/h6H,2-5,8H2,1H3
InChIKeyIKXGPPHDHKWSSZ-UHFFFAOYSA-N
MW126.20 g/mol
LogP0.04
Rot. Bonds

About 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine

3-methyl-3-azabicyclo[4.1.0]heptan-1-amine (PubChem CID 82651001) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine.

Molecular Properties

Compound Name3-methyl-3-azabicyclo[4.1.0]heptan-1-amine
PubChem CID82651001
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name3-methyl-3-azabicyclo[4.1.0]heptan-1-amine
SMILESCN1CCC2CC2(N)C1
InChIInChI=1S/C7H14N2/c1-9-3-2-6-4-7(6,8)5-9/h6H,2-5,8H2,1H3
InChIKeyIKXGPPHDHKWSSZ-UHFFFAOYSA-N
XLogP0.04
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methyl-3-azabicyclo[4.1.0]heptan-1-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

1-Methyl-2-azabicyclo[4.1.0]heptane
CID 75994690
(1R,5S,6S)-5-fluoro-3-methyl-3-azabicyclo[4.1.0]heptan-6-amine
CID 178125860
3-Azabicyclo[4.1.0]heptan-1-amine
CID 54382136
3-Methyl-3-azabicyclo[4.1.0]heptan-7-amine
CID 82418789
3-Azabicyclo[4.1.0]heptan-1-amine dihydrochloride
CID 90114299
[(1R,6R,7R)-3-methyl-3-azabicyclo[4.1.0]heptan-7-yl]methanamine
CID 92547246
3-Azabicyclo[4.1.0]heptan-6-amine
CID 117045485
2-(2-Azabicyclo[4.1.0]heptan-2-YL)ethanamine
CID 117045927
3-Methyl-3-azabicyclo[4.1.0]heptan-6-amine
CID 117273465
3-Ethyl-3-azabicyclo[4.1.0]heptan-1-amine
CID 117273467
[(3S)-2-methyl-2-azabicyclo[4.1.0]heptan-3-yl]methanamine
CID 117934999
N-methyl-3-azabicyclo[4.1.0]heptan-6-amine
CID 118405146

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine?
The IUPAC name of 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine (CID 82651001) is 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine.
What is the SMILES notation for 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine?
The canonical SMILES for 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine is CN1CCC2CC2(N)C1.
What is the InChIKey of 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine?
The InChIKey is IKXGPPHDHKWSSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-9-3-2-6-4-7(6,8)5-9/h6H,2-5,8H2,1H3.
What are the key properties of 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine?
3-methyl-3-azabicyclo[4.1.0]heptan-1-amine has a molecular weight of 126.20 g/mol, XLogP of 0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-azabicyclo[4.1.0]heptan-1-amine is sourced from PubChem (CID 82651001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).