4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine

C15H27N3 — CID 106558973

IUPAC4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine
SMILESCc1cn(C2CCCCC2C)c(NCC(C)C)n1
InChIInChI=1S/C15H27N3/c1-11(2)9-16-15-17-13(4)10-18(15)14-8-6-5-7-12(14)3/h10-12,14H,5-9H2,1-4H3,(H,16,17)
InChIKeyYQMIJFFLEDOGPA-UHFFFAOYSA-N
MW249.40 g/mol
LogP4.01
Rot. Bonds4

About 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine

4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine (PubChem CID 106558973) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine
PubChem CID106558973
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine
SMILESCc1cn(C2CCCCC2C)c(NCC(C)C)n1
InChIInChI=1S/C15H27N3/c1-11(2)9-16-15-17-13(4)10-18(15)14-8-6-5-7-12(14)3/h10-12,14H,5-9H2,1-4H3,(H,16,17)
InChIKeyYQMIJFFLEDOGPA-UHFFFAOYSA-N
XLogP4.01
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine?
The IUPAC name of 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine (CID 106558973) is 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine is Cc1cn(C2CCCCC2C)c(NCC(C)C)n1.
What is the InChIKey of 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine?
The InChIKey is YQMIJFFLEDOGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-11(2)9-16-15-17-13(4)10-18(15)14-8-6-5-7-12(14)3/h10-12,14H,5-9H2,1-4H3,(H,16,17).
What are the key properties of 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine?
4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine has a molecular weight of 249.40 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylcyclohexyl)-N-(2-methylpropyl)imidazol-2-amine is sourced from PubChem (CID 106558973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).