2-cyclohexyl-4-pentylimidazole-1,5-diamine

C14H26N4 — CID 62507105

IUPAC2-cyclohexyl-4-pentylimidazole-1,5-diamine
SMILESCCCCCc1nc(C2CCCCC2)n(N)c1N
InChIInChI=1S/C14H26N4/c1-2-3-5-10-12-13(15)18(16)14(17-12)11-8-6-4-7-9-11/h11H,2-10,15-16H2,1H3
InChIKeyKTWARUFQMVWQSS-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.96
Rot. Bonds5

About 2-cyclohexyl-4-pentylimidazole-1,5-diamine

2-cyclohexyl-4-pentylimidazole-1,5-diamine (PubChem CID 62507105) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-cyclohexyl-4-pentylimidazole-1,5-diamine.

Molecular Properties

Compound Name2-cyclohexyl-4-pentylimidazole-1,5-diamine
PubChem CID62507105
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2-cyclohexyl-4-pentylimidazole-1,5-diamine
SMILESCCCCCc1nc(C2CCCCC2)n(N)c1N
InChIInChI=1S/C14H26N4/c1-2-3-5-10-12-13(15)18(16)14(17-12)11-8-6-4-7-9-11/h11H,2-10,15-16H2,1H3
InChIKeyKTWARUFQMVWQSS-UHFFFAOYSA-N
XLogP2.96
TPSA69.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-cyclohexyl-4-heptylimidazole-1,5-diamine
CID 63468221
2-cyclopentyl-5-hexyl-3-propan-2-ylimidazol-4-amine
CID 62219186
2-cyclopropyl-3-ethyl-5-hexylimidazol-4-amine
CID 55048836
2,3-dicyclopropyl-5-hexylimidazol-4-amine
CID 62220748
2-cyclopentyl-3-methyl-5-(3-methylsulfanylpropyl)imidazol-4-amine
CID 103090267
3-butyl-2-cyclohexyl-5-(2,2-dimethylpropyl)imidazol-4-amine
CID 63467488
2-cyclopentyl-5-ethyl-3-methylimidazol-4-amine
CID 62219518
2-cyclohexyl-4-(3-propylimidazol-4-yl)imidazole-1,5-diamine
CID 66132148
2-cyclopentyl-5-ethyl-3-propan-2-ylimidazol-4-amine
CID 62219181
3-cyclopropyl-2-ethyl-5-pentylimidazol-4-amine
CID 62220445
2-cyclopentyl-5-(2-methylsulfanylethyl)-3-propan-2-ylimidazol-4-amine
CID 62219183
2-cyclopentyl-4-(4-methylpentan-2-yl)imidazole-1,5-diamine
CID 114201131

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-4-pentylimidazole-1,5-diamine?
The IUPAC name of 2-cyclohexyl-4-pentylimidazole-1,5-diamine (CID 62507105) is 2-cyclohexyl-4-pentylimidazole-1,5-diamine.
What is the SMILES notation for 2-cyclohexyl-4-pentylimidazole-1,5-diamine?
The canonical SMILES for 2-cyclohexyl-4-pentylimidazole-1,5-diamine is CCCCCc1nc(C2CCCCC2)n(N)c1N.
What is the InChIKey of 2-cyclohexyl-4-pentylimidazole-1,5-diamine?
The InChIKey is KTWARUFQMVWQSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-2-3-5-10-12-13(15)18(16)14(17-12)11-8-6-4-7-9-11/h11H,2-10,15-16H2,1H3.
What are the key properties of 2-cyclohexyl-4-pentylimidazole-1,5-diamine?
2-cyclohexyl-4-pentylimidazole-1,5-diamine has a molecular weight of 250.39 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-4-pentylimidazole-1,5-diamine is sourced from PubChem (CID 62507105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).