(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine

C13H23N3 — CID 104943263

IUPAC(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine
SMILESC[C@@H](N)c1cncn1C1CCC(C)(C)CC1
InChIInChI=1S/C13H23N3/c1-10(14)12-8-15-9-16(12)11-4-6-13(2,3)7-5-11/h8-11H,4-7,14H2,1-3H3/t10-/m1/s1
InChIKeyWXLHNKFNIPDVQK-SNVBAGLBSA-N
MW221.35 g/mol
LogP3.04
Rot. Bonds2

About (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine

(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine (PubChem CID 104943263) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine
PubChem CID104943263
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine
SMILESC[C@@H](N)c1cncn1C1CCC(C)(C)CC1
InChIInChI=1S/C13H23N3/c1-10(14)12-8-15-9-16(12)11-4-6-13(2,3)7-5-11/h8-11H,4-7,14H2,1-3H3/t10-/m1/s1
InChIKeyWXLHNKFNIPDVQK-SNVBAGLBSA-N
XLogP3.04
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine 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

(1R)-1-[3-(3-methylcyclobutyl)imidazol-4-yl]ethanamine
CID 104943894
(1R)-1-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
CID 104943974
(1S)-1-[3-(3-methylcyclopentyl)imidazol-4-yl]ethanamine
CID 104943969
1-[3-(1,1-dioxothietan-3-yl)imidazol-4-yl]ethanamine
CID 130921357
1-[3-(1,2-dimethylpiperidin-4-yl)imidazol-4-yl]ethanamine
CID 114706919
(1S)-1-[3-(3-ethylcyclohexyl)imidazol-4-yl]ethanamine
CID 104943270
1-[3-(1,1-dioxothian-3-yl)imidazol-4-yl]ethanamine
CID 114706024
2-methyl-1-[3-(4-methylcyclohexyl)imidazol-4-yl]propan-1-amine
CID 102969473
4-amino-3-(3-cyclopropylimidazol-4-yl)pentan-1-ol
CID 66140672
(1R)-1-[3-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)imidazol-4-yl]ethanamine
CID 104942556
1-(3-cyclopropylimidazol-4-yl)-2,2,2-trifluoroethanamine
CID 66140665
1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]-N-methylmethanamine
CID 66151421

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine?
The IUPAC name of (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine (CID 104943263) is (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine.
What is the SMILES notation for (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine?
The canonical SMILES for (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine is C[C@@H](N)c1cncn1C1CCC(C)(C)CC1.
What is the InChIKey of (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine?
The InChIKey is WXLHNKFNIPDVQK-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H23N3/c1-10(14)12-8-15-9-16(12)11-4-6-13(2,3)7-5-11/h8-11H,4-7,14H2,1-3H3/t10-/m1/s1.
What are the key properties of (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine?
(1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine has a molecular weight of 221.35 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[3-(4,4-dimethylcyclohexyl)imidazol-4-yl]ethanamine is sourced from PubChem (CID 104943263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).