5-(5-phenylpentyl)-1H-imidazol-2-amine

C14H19N3 — CID 46848173

IUPAC5-(5-phenylpentyl)-1H-imidazol-2-amine
SMILESNc1ncc(CCCCCc2ccccc2)[nH]1
InChIInChI=1S/C14H19N3/c15-14-16-11-13(17-14)10-6-2-5-9-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H3,15,16,17)
InChIKeyBAUKFKPEJAPXNL-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.95
Rot. Bonds6

About 5-(5-phenylpentyl)-1H-imidazol-2-amine

5-(5-phenylpentyl)-1H-imidazol-2-amine (PubChem CID 46848173) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 5-(5-phenylpentyl)-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(5-phenylpentyl)-1H-imidazol-2-amine
PubChem CID46848173
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name5-(5-phenylpentyl)-1H-imidazol-2-amine
SMILESNc1ncc(CCCCCc2ccccc2)[nH]1
InChIInChI=1S/C14H19N3/c15-14-16-11-13(17-14)10-6-2-5-9-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H3,15,16,17)
InChIKeyBAUKFKPEJAPXNL-UHFFFAOYSA-N
XLogP2.95
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-heptadecyl-1H-imidazol-2-amine
CID 25178085
1-[4-[3-(2-amino-1H-imidazol-5-yl)propyl]triazol-1-yl]-5-phenylpentan-2-one
CID 58264426
4-phenylbutylbenzene
CID 141301927
5-[3-(2H-triazol-4-yl)propyl]-1H-imidazol-2-amine
CID 143882890
hafnium;4-phenylbutylbenzene
CID 175889972
methane;4-phenylbutylbenzene
CID 173386802
5-(5-phenylpentyl)pyrimidine-2,4-diamine
CID 134120441
13-phenyltridecan-1-amine
CID 19801439
trichloro(5-phenylpentyl)silane
CID 59465093
2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid
CID 46237591
5-[6-(methyldiazenyl)-7-[(2-methyl-3-phenylbutyl)amino]heptyl]-1H-imidazol-2-amine
CID 91264361
1,2-bis[5-(3-phenylpropyl)-1H-imidazol-2-yl]ethanol
CID 164519484

Frequently Asked Questions

What is the IUPAC name of 5-(5-phenylpentyl)-1H-imidazol-2-amine?
The IUPAC name of 5-(5-phenylpentyl)-1H-imidazol-2-amine (CID 46848173) is 5-(5-phenylpentyl)-1H-imidazol-2-amine.
What is the SMILES notation for 5-(5-phenylpentyl)-1H-imidazol-2-amine?
The canonical SMILES for 5-(5-phenylpentyl)-1H-imidazol-2-amine is Nc1ncc(CCCCCc2ccccc2)[nH]1.
What is the InChIKey of 5-(5-phenylpentyl)-1H-imidazol-2-amine?
The InChIKey is BAUKFKPEJAPXNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c15-14-16-11-13(17-14)10-6-2-5-9-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H3,15,16,17).
What are the key properties of 5-(5-phenylpentyl)-1H-imidazol-2-amine?
5-(5-phenylpentyl)-1H-imidazol-2-amine has a molecular weight of 229.33 g/mol, XLogP of 2.95, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-phenylpentyl)-1H-imidazol-2-amine is sourced from PubChem (CID 46848173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).