4-methyl-1-(4-methylpentyl)imidazol-2-amine

C10H19N3 — CID 106572208

IUPAC4-methyl-1-(4-methylpentyl)imidazol-2-amine
SMILESCc1cn(CCCC(C)C)c(N)n1
InChIInChI=1S/C10H19N3/c1-8(2)5-4-6-13-7-9(3)12-10(13)11/h7-8H,4-6H2,1-3H3,(H2,11,12)
InChIKeyZCUDKBJNYRUZAR-UHFFFAOYSA-N
MW181.28 g/mol
LogP2.21
Rot. Bonds4

About 4-methyl-1-(4-methylpentyl)imidazol-2-amine

4-methyl-1-(4-methylpentyl)imidazol-2-amine (PubChem CID 106572208) has the molecular formula C10H19N3 and a molecular weight of 181.28 g/mol. Its IUPAC name is 4-methyl-1-(4-methylpentyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-(4-methylpentyl)imidazol-2-amine
PubChem CID106572208
Molecular FormulaC10H19N3
Molecular Weight181.28 g/mol
Exact Mass181.16
IUPAC Name4-methyl-1-(4-methylpentyl)imidazol-2-amine
SMILESCc1cn(CCCC(C)C)c(N)n1
InChIInChI=1S/C10H19N3/c1-8(2)5-4-6-13-7-9(3)12-10(13)11/h7-8H,4-6H2,1-3H3,(H2,11,12)
InChIKeyZCUDKBJNYRUZAR-UHFFFAOYSA-N
XLogP2.21
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-1-(4-methylpentyl)imidazol-2-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 4-methyl-1-(4-methylpentyl)imidazol-2-amine?
The IUPAC name of 4-methyl-1-(4-methylpentyl)imidazol-2-amine (CID 106572208) is 4-methyl-1-(4-methylpentyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-(4-methylpentyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-1-(4-methylpentyl)imidazol-2-amine is Cc1cn(CCCC(C)C)c(N)n1.
What is the InChIKey of 4-methyl-1-(4-methylpentyl)imidazol-2-amine?
The InChIKey is ZCUDKBJNYRUZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3/c1-8(2)5-4-6-13-7-9(3)12-10(13)11/h7-8H,4-6H2,1-3H3,(H2,11,12).
What are the key properties of 4-methyl-1-(4-methylpentyl)imidazol-2-amine?
4-methyl-1-(4-methylpentyl)imidazol-2-amine has a molecular weight of 181.28 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methylpentyl)imidazol-2-amine is sourced from PubChem (CID 106572208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).