1-(2-phenylimidazol-1-yl)pentan-2-ol

C14H18N2O — CID 62043887

IUPAC1-(2-phenylimidazol-1-yl)pentan-2-ol
SMILESCCCC(O)Cn1ccnc1-c1ccccc1
InChIInChI=1S/C14H18N2O/c1-2-6-13(17)11-16-10-9-15-14(16)12-7-4-3-5-8-12/h3-5,7-10,13,17H,2,6,11H2,1H3
InChIKeyVNQYNZRDFMMRTK-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.71
Rot. Bonds5

About 1-(2-phenylimidazol-1-yl)pentan-2-ol

1-(2-phenylimidazol-1-yl)pentan-2-ol (PubChem CID 62043887) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(2-phenylimidazol-1-yl)pentan-2-ol.

Molecular Properties

Compound Name1-(2-phenylimidazol-1-yl)pentan-2-ol
PubChem CID62043887
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-(2-phenylimidazol-1-yl)pentan-2-ol
SMILESCCCC(O)Cn1ccnc1-c1ccccc1
InChIInChI=1S/C14H18N2O/c1-2-6-13(17)11-16-10-9-15-14(16)12-7-4-3-5-8-12/h3-5,7-10,13,17H,2,6,11H2,1H3
InChIKeyVNQYNZRDFMMRTK-UHFFFAOYSA-N
XLogP2.71
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-phenylimidazol-1-yl)butan-2-ol
CID 58743669
N-methyl-1-(2-phenylimidazol-1-yl)pentan-2-amine
CID 62042759
1-(2-phenylimidazol-1-yl)propan-2-ol
CID 58743625
2-methyl-3-(2-phenylimidazol-1-yl)propanenitrile
CID 55139509
2-ethoxy-3-(2-phenylimidazol-1-yl)propanoic acid
CID 63075138
1-(2,6-difluorophenyl)-2-(2-phenylimidazol-1-yl)ethanol
CID 111440105
1-(4-aminophenyl)-2-(2-phenylimidazol-1-yl)ethanol
CID 62265055
2-(2-phenylimidazol-1-yl)acetic acid
CID 3145945
1-[(2-fluorophenyl)methoxy]-3-(2-phenylimidazol-1-yl)propan-2-ol
CID 111440098
2-methyl-3-(2-phenylimidazol-1-yl)propanimidamide
CID 61071225
1-methoxy-3-(2-phenylimidazol-1-yl)propan-2-amine
CID 107506135
(2R)-1-[2-[4-(difluoromethoxy)phenyl]imidazol-1-yl]butan-2-ol
CID 95552944

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylimidazol-1-yl)pentan-2-ol?
The IUPAC name of 1-(2-phenylimidazol-1-yl)pentan-2-ol (CID 62043887) is 1-(2-phenylimidazol-1-yl)pentan-2-ol.
What is the SMILES notation for 1-(2-phenylimidazol-1-yl)pentan-2-ol?
The canonical SMILES for 1-(2-phenylimidazol-1-yl)pentan-2-ol is CCCC(O)Cn1ccnc1-c1ccccc1.
What is the InChIKey of 1-(2-phenylimidazol-1-yl)pentan-2-ol?
The InChIKey is VNQYNZRDFMMRTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-2-6-13(17)11-16-10-9-15-14(16)12-7-4-3-5-8-12/h3-5,7-10,13,17H,2,6,11H2,1H3.
What are the key properties of 1-(2-phenylimidazol-1-yl)pentan-2-ol?
1-(2-phenylimidazol-1-yl)pentan-2-ol has a molecular weight of 230.31 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylimidazol-1-yl)pentan-2-ol is sourced from PubChem (CID 62043887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).