[1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol

C17H23N3O — CID 79179323

IUPAC[1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol
SMILESCc1ncc(CNC2(CO)CCCC2)n1-c1ccccc1
InChIInChI=1S/C17H23N3O/c1-14-18-11-16(20(14)15-7-3-2-4-8-15)12-19-17(13-21)9-5-6-10-17/h2-4,7-8,11,19,21H,5-6,9-10,12-13H2,1H3
InChIKeyOGXPNSFHOCFMSO-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.58
Rot. Bonds5

About [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol

[1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol (PubChem CID 79179323) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol
PubChem CID79179323
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name[1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol
SMILESCc1ncc(CNC2(CO)CCCC2)n1-c1ccccc1
InChIInChI=1S/C17H23N3O/c1-14-18-11-16(20(14)15-7-3-2-4-8-15)12-19-17(13-21)9-5-6-10-17/h2-4,7-8,11,19,21H,5-6,9-10,12-13H2,1H3
InChIKeyOGXPNSFHOCFMSO-UHFFFAOYSA-N
XLogP2.58
TPSA50.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol?
The IUPAC name of [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol (CID 79179323) is [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol.
What is the SMILES notation for [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol?
The canonical SMILES for [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol is Cc1ncc(CNC2(CO)CCCC2)n1-c1ccccc1.
What is the InChIKey of [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol?
The InChIKey is OGXPNSFHOCFMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-14-18-11-16(20(14)15-7-3-2-4-8-15)12-19-17(13-21)9-5-6-10-17/h2-4,7-8,11,19,21H,5-6,9-10,12-13H2,1H3.
What are the key properties of [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol?
[1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol has a molecular weight of 285.39 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methyl-3-phenylimidazol-4-yl)methylamino]cyclopentyl]methanol is sourced from PubChem (CID 79179323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).