2-(4-imidazol-1-ylphenyl)propan-1-ol

C12H14N2O — CID 117290878

IUPAC2-(4-imidazol-1-ylphenyl)propan-1-ol
SMILESCC(CO)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C12H14N2O/c1-10(8-15)11-2-4-12(5-3-11)14-7-6-13-9-14/h2-7,9-10,15H,8H2,1H3
InChIKeyFDKKDJSZINNRTG-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.97
Rot. Bonds3

About 2-(4-imidazol-1-ylphenyl)propan-1-ol

2-(4-imidazol-1-ylphenyl)propan-1-ol (PubChem CID 117290878) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(4-imidazol-1-ylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(4-imidazol-1-ylphenyl)propan-1-ol
PubChem CID117290878
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-(4-imidazol-1-ylphenyl)propan-1-ol
SMILESCC(CO)c1ccc(-n2ccnc2)cc1
InChIInChI=1S/C12H14N2O/c1-10(8-15)11-2-4-12(5-3-11)14-7-6-13-9-14/h2-7,9-10,15H,8H2,1H3
InChIKeyFDKKDJSZINNRTG-UHFFFAOYSA-N
XLogP1.97
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-imidazol-1-ylphenyl)ethanamine;dihydrochloride
CID 91654248
1-[4-[1,2,2-tris(4-imidazol-1-ylphenyl)ethyl]phenyl]imidazole
CID 162718283
2-(3-chloro-4-imidazol-1-ylphenyl)propan-1-ol
CID 117345846
1,3-bis[1-(4-imidazol-1-ylphenyl)ethyl]urea
CID 174999274
2,2-difluoro-N-[1-(4-imidazol-1-ylphenyl)ethyl]ethanamine
CID 113303609
1-[4-[(1R)-1-(sulfamoylamino)ethyl]phenyl]imidazole
CID 97088566
1-(4-imidazol-1-ylphenyl)-N-(2-methoxyethyl)ethanamine
CID 43200664
1-(4-imidazol-1-ylphenyl)-N-[(1-methylpyrazol-3-yl)methyl]ethanamine
CID 78919895
2-[[[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]amino]methyl]phenol
CID 95300346
1-[1-(4-imidazol-1-ylphenyl)ethylamino]-4-methylpentan-2-ol
CID 103779743
1,1-difluoro-3-[1-(4-imidazol-1-ylphenyl)ethylamino]propan-2-ol
CID 103787996
2-hydroxy-2-(4-imidazol-1-ylphenyl)acetic acid
CID 117310612

Frequently Asked Questions

What is the IUPAC name of 2-(4-imidazol-1-ylphenyl)propan-1-ol?
The IUPAC name of 2-(4-imidazol-1-ylphenyl)propan-1-ol (CID 117290878) is 2-(4-imidazol-1-ylphenyl)propan-1-ol.
What is the SMILES notation for 2-(4-imidazol-1-ylphenyl)propan-1-ol?
The canonical SMILES for 2-(4-imidazol-1-ylphenyl)propan-1-ol is CC(CO)c1ccc(-n2ccnc2)cc1.
What is the InChIKey of 2-(4-imidazol-1-ylphenyl)propan-1-ol?
The InChIKey is FDKKDJSZINNRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-10(8-15)11-2-4-12(5-3-11)14-7-6-13-9-14/h2-7,9-10,15H,8H2,1H3.
What are the key properties of 2-(4-imidazol-1-ylphenyl)propan-1-ol?
2-(4-imidazol-1-ylphenyl)propan-1-ol has a molecular weight of 202.26 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-imidazol-1-ylphenyl)propan-1-ol is sourced from PubChem (CID 117290878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).