3,5-dimethylcyclohexan-1-amine

C8H17N — CID 14675374

IUPAC3,5-dimethylcyclohexan-1-amine
SMILESCC1CC(C)CC(N)C1
InChIInChI=1S/C8H17N/c1-6-3-7(2)5-8(9)4-6/h6-8H,3-5,9H2,1-2H3
InChIKeyAUVPFHDQSZJPSZ-UHFFFAOYSA-N
MW127.23 g/mol
LogP1.77
Rot. Bonds

About 3,5-dimethylcyclohexan-1-amine

3,5-dimethylcyclohexan-1-amine (PubChem CID 14675374) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is 3,5-dimethylcyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethylcyclohexan-1-amine
PubChem CID14675374
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name3,5-dimethylcyclohexan-1-amine
SMILESCC1CC(C)CC(N)C1
InChIInChI=1S/C8H17N/c1-6-3-7(2)5-8(9)4-6/h6-8H,3-5,9H2,1-2H3
InChIKeyAUVPFHDQSZJPSZ-UHFFFAOYSA-N
XLogP1.77
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3,5-dimethylcyclohexan-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

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethylcyclohexan-1-amine?
The IUPAC name of 3,5-dimethylcyclohexan-1-amine (CID 14675374) is 3,5-dimethylcyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethylcyclohexan-1-amine?
The canonical SMILES for 3,5-dimethylcyclohexan-1-amine is CC1CC(C)CC(N)C1.
What is the InChIKey of 3,5-dimethylcyclohexan-1-amine?
The InChIKey is AUVPFHDQSZJPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N/c1-6-3-7(2)5-8(9)4-6/h6-8H,3-5,9H2,1-2H3.
What are the key properties of 3,5-dimethylcyclohexan-1-amine?
3,5-dimethylcyclohexan-1-amine has a molecular weight of 127.23 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylcyclohexan-1-amine is sourced from PubChem (CID 14675374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).