1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine

C15H25N3 — CID 106571292

IUPAC1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine
SMILESCc1cn(C(C)C2CCCCC2)c(NC2CC2)n1
InChIInChI=1S/C15H25N3/c1-11-10-18(15(16-11)17-14-8-9-14)12(2)13-6-4-3-5-7-13/h10,12-14H,3-9H2,1-2H3,(H,16,17)
InChIKeyQQNHWTVKQUWTJZ-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.91
Rot. Bonds4

About 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine

1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine (PubChem CID 106571292) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine.

Molecular Properties

Compound Name1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine
PubChem CID106571292
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine
SMILESCc1cn(C(C)C2CCCCC2)c(NC2CC2)n1
InChIInChI=1S/C15H25N3/c1-11-10-18(15(16-11)17-14-8-9-14)12(2)13-6-4-3-5-7-13/h10,12-14H,3-9H2,1-2H3,(H,16,17)
InChIKeyQQNHWTVKQUWTJZ-UHFFFAOYSA-N
XLogP3.91
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine?
The IUPAC name of 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine (CID 106571292) is 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine.
What is the SMILES notation for 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine?
The canonical SMILES for 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine is Cc1cn(C(C)C2CCCCC2)c(NC2CC2)n1.
What is the InChIKey of 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine?
The InChIKey is QQNHWTVKQUWTJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-11-10-18(15(16-11)17-14-8-9-14)12(2)13-6-4-3-5-7-13/h10,12-14H,3-9H2,1-2H3,(H,16,17).
What are the key properties of 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine?
1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine has a molecular weight of 247.39 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclohexylethyl)-N-cyclopropyl-4-methylimidazol-2-amine is sourced from PubChem (CID 106571292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).