5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine

C14H25N3 — CID 55048210

IUPAC5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCc1nc(C2CCCCC2)c(N)n1CC(C)C
InChIInChI=1S/C14H25N3/c1-10(2)9-17-11(3)16-13(14(17)15)12-7-5-4-6-8-12/h10,12H,4-9,15H2,1-3H3
InChIKeyUMKBEKFHJUMPPZ-UHFFFAOYSA-N
MW235.38 g/mol
LogP3.48
Rot. Bonds3

About 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine

5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine (PubChem CID 55048210) has the molecular formula C14H25N3 and a molecular weight of 235.38 g/mol. Its IUPAC name is 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine.

Molecular Properties

Compound Name5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine
PubChem CID55048210
Molecular FormulaC14H25N3
Molecular Weight235.38 g/mol
Exact Mass235.20
IUPAC Name5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine
SMILESCc1nc(C2CCCCC2)c(N)n1CC(C)C
InChIInChI=1S/C14H25N3/c1-10(2)9-17-11(3)16-13(14(17)15)12-7-5-4-6-8-12/h10,12H,4-9,15H2,1-3H3
InChIKeyUMKBEKFHJUMPPZ-UHFFFAOYSA-N
XLogP3.48
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.38
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
The IUPAC name of 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine (CID 55048210) is 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine.
What is the SMILES notation for 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
The canonical SMILES for 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine is Cc1nc(C2CCCCC2)c(N)n1CC(C)C.
What is the InChIKey of 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
The InChIKey is UMKBEKFHJUMPPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-10(2)9-17-11(3)16-13(14(17)15)12-7-5-4-6-8-12/h10,12H,4-9,15H2,1-3H3.
What are the key properties of 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine?
5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine has a molecular weight of 235.38 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2-methyl-3-(2-methylpropyl)imidazol-4-amine is sourced from PubChem (CID 55048210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).