N-methyl-3-azabicyclo[4.1.0]heptan-6-amine

C7H14N2 — CID 118405146

IUPACN-methyl-3-azabicyclo[4.1.0]heptan-6-amine
SMILESCNC12CCNCC1C2
InChIInChI=1S/C7H14N2/c1-8-7-2-3-9-5-6(7)4-7/h6,8-9H,2-5H2,1H3
InChIKeyHMAWXWSOIDHFCE-UHFFFAOYSA-N
MW126.20 g/mol
LogP-0.04
Rot. Bonds1

About N-methyl-3-azabicyclo[4.1.0]heptan-6-amine

N-methyl-3-azabicyclo[4.1.0]heptan-6-amine (PubChem CID 118405146) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is N-methyl-3-azabicyclo[4.1.0]heptan-6-amine.

Molecular Properties

Compound NameN-methyl-3-azabicyclo[4.1.0]heptan-6-amine
PubChem CID118405146
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC NameN-methyl-3-azabicyclo[4.1.0]heptan-6-amine
SMILESCNC12CCNCC1C2
InChIInChI=1S/C7H14N2/c1-8-7-2-3-9-5-6(7)4-7/h6,8-9H,2-5H2,1H3
InChIKeyHMAWXWSOIDHFCE-UHFFFAOYSA-N
XLogP-0.04
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-3-azabicyclo[4.1.0]heptan-6-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

3-Azabicyclo[4.1.0]heptane hydrochloride
CID 74889690
1-Methyl-2-azabicyclo[4.1.0]heptane hydrochloride
CID 75994689
3-Aza-bicyclo[4.1.0]heptane
CID 20521861
2-Azabicyclo[4.1.0]heptane
CID 21998683
1-Methyl-2-azabicyclo[4.1.0]heptane
CID 75994690
7-Fluoro-7-methyl-3-azabicyclo[4.1.0]heptane
CID 176557058
(5S,6R)-5-fluoro-3-azabicyclo[4.1.0]heptan-6-amine
CID 178124905
(1R,5S,6S)-5-fluoro-3-methyl-3-azabicyclo[4.1.0]heptan-6-amine
CID 178125860
4-Methyl-3-azabicyclo[4.1.0]heptane
CID 21339025
N-cyclopropyl-3-ethylpiperidin-4-amine
CID 22278879
6-Methyl-3-aza-bicyclo[4.1.0]heptane
CID 44138765
(1S,6S)-3-azabicyclo[4.1.0]heptane
CID 51606321

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-azabicyclo[4.1.0]heptan-6-amine?
The IUPAC name of N-methyl-3-azabicyclo[4.1.0]heptan-6-amine (CID 118405146) is N-methyl-3-azabicyclo[4.1.0]heptan-6-amine.
What is the SMILES notation for N-methyl-3-azabicyclo[4.1.0]heptan-6-amine?
The canonical SMILES for N-methyl-3-azabicyclo[4.1.0]heptan-6-amine is CNC12CCNCC1C2.
What is the InChIKey of N-methyl-3-azabicyclo[4.1.0]heptan-6-amine?
The InChIKey is HMAWXWSOIDHFCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-8-7-2-3-9-5-6(7)4-7/h6,8-9H,2-5H2,1H3.
What are the key properties of N-methyl-3-azabicyclo[4.1.0]heptan-6-amine?
N-methyl-3-azabicyclo[4.1.0]heptan-6-amine has a molecular weight of 126.20 g/mol, XLogP of -0.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-azabicyclo[4.1.0]heptan-6-amine is sourced from PubChem (CID 118405146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).