N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine

C11H19N3 — CID 106575331

IUPACN-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine
SMILESCC1CC(C)CC(Nc2ncc[nH]2)C1
InChIInChI=1S/C11H19N3/c1-8-5-9(2)7-10(6-8)14-11-12-3-4-13-11/h3-4,8-10H,5-7H2,1-2H3,(H2,12,13,14)
InChIKeyABRBNKZOXOATIO-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.65
Rot. Bonds2

About N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine

N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine (PubChem CID 106575331) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine
PubChem CID106575331
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine
SMILESCC1CC(C)CC(Nc2ncc[nH]2)C1
InChIInChI=1S/C11H19N3/c1-8-5-9(2)7-10(6-8)14-11-12-3-4-13-11/h3-4,8-10H,5-7H2,1-2H3,(H2,12,13,14)
InChIKeyABRBNKZOXOATIO-UHFFFAOYSA-N
XLogP2.65
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine (CID 106575331) is N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine is CC1CC(C)CC(Nc2ncc[nH]2)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine?
The InChIKey is ABRBNKZOXOATIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8-5-9(2)7-10(6-8)14-11-12-3-4-13-11/h3-4,8-10H,5-7H2,1-2H3,(H2,12,13,14).
What are the key properties of N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine?
N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-1H-imidazol-2-amine is sourced from PubChem (CID 106575331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).