5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine

C14H19N3 — CID 43651216

IUPAC5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine
SMILESNCCCCCc1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C14H19N3/c15-10-6-2-5-9-14-16-11-13(17-14)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,15H2,(H,16,17)
InChIKeyXWCAGLDKYLEQQO-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.75
Rot. Bonds6

About 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine

5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine (PubChem CID 43651216) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine.

Molecular Properties

Compound Name5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine
PubChem CID43651216
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine
SMILESNCCCCCc1ncc(-c2ccccc2)[nH]1
InChIInChI=1S/C14H19N3/c15-10-6-2-5-9-14-16-11-13(17-14)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,15H2,(H,16,17)
InChIKeyXWCAGLDKYLEQQO-UHFFFAOYSA-N
XLogP2.75
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 ≤ 52.75
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-[5-(4-fluorophenyl)-1H-imidazol-2-yl]pentan-1-amine
CID 43651189
2-(5-phenyl-1H-imidazol-2-yl)ethanamine;dihydrochloride
CID 13170817
6-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]hexan-1-amine
CID 43651783
6-[5-(2-bromophenyl)-1H-imidazol-2-yl]hexan-1-amine
CID 43651769
5-[5-(3,4-difluorophenyl)-1H-imidazol-2-yl]pentan-1-amine
CID 43651162
azane;5-phenyl-2-(3-phenylpropyl)-1H-imidazole
CID 174441840
5-(5-naphthalen-1-yl-1H-imidazol-2-yl)pentan-1-amine
CID 43651211
6-[5-(5-fluoro-2-pyridinyl)-1H-imidazol-2-yl]hexan-1-amine
CID 83125480
6-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]hexan-1-amine
CID 43651738
3-[5-(3,4-difluorophenyl)-1H-imidazol-2-yl]propan-1-amine
CID 43650814
5-[5-(2,4-dichlorophenyl)-1H-imidazol-2-yl]pentan-1-amine
CID 43651166
3-(5-phenyl-1H-imidazol-2-yl)propoxy-tri(propan-2-yl)silane
CID 154633145

Frequently Asked Questions

What is the IUPAC name of 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine?
The IUPAC name of 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine (CID 43651216) is 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine.
What is the SMILES notation for 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine?
The canonical SMILES for 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine is NCCCCCc1ncc(-c2ccccc2)[nH]1.
What is the InChIKey of 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine?
The InChIKey is XWCAGLDKYLEQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c15-10-6-2-5-9-14-16-11-13(17-14)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,15H2,(H,16,17).
What are the key properties of 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine?
5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine has a molecular weight of 229.33 g/mol, XLogP of 2.75, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine is sourced from PubChem (CID 43651216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).