trans-(1R,2R)-2-methylcyclohexan-1-amine

C7H15N — CID 6993482

IUPACtrans-(1R,2R)-2-methylcyclohexan-1-amine
SMILESC[C@@H]1CCCC[C@H]1N
InChIInChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7-/m1/s1
InChIKeyFEUISMYEFPANSS-RNFRBKRXSA-N
MW113.20 g/mol
LogP1.52
Rot. Bonds

About trans-(1R,2R)-2-methylcyclohexan-1-amine

trans-(1R,2R)-2-methylcyclohexan-1-amine (PubChem CID 6993482) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is trans-(1R,2R)-2-methylcyclohexan-1-amine.

Molecular Properties

Compound Nametrans-(1R,2R)-2-methylcyclohexan-1-amine
PubChem CID6993482
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Nametrans-(1R,2R)-2-methylcyclohexan-1-amine
SMILESC[C@@H]1CCCC[C@H]1N
InChIInChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7-/m1/s1
InChIKeyFEUISMYEFPANSS-RNFRBKRXSA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze trans-(1R,2R)-2-methylcyclohexan-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 trans-(1R,2R)-2-methylcyclohexan-1-amine?
The IUPAC name of trans-(1R,2R)-2-methylcyclohexan-1-amine (CID 6993482) is trans-(1R,2R)-2-methylcyclohexan-1-amine.
What is the SMILES notation for trans-(1R,2R)-2-methylcyclohexan-1-amine?
The canonical SMILES for trans-(1R,2R)-2-methylcyclohexan-1-amine is C[C@@H]1CCCC[C@H]1N.
What is the InChIKey of trans-(1R,2R)-2-methylcyclohexan-1-amine?
The InChIKey is FEUISMYEFPANSS-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7-/m1/s1.
What are the key properties of trans-(1R,2R)-2-methylcyclohexan-1-amine?
trans-(1R,2R)-2-methylcyclohexan-1-amine has a molecular weight of 113.20 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-methylcyclohexan-1-amine is sourced from PubChem (CID 6993482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).