3-imidazol-1-yl-1,1-diphenylpropan-1-ol

C18H18N2O — CID 24895248

IUPAC3-imidazol-1-yl-1,1-diphenylpropan-1-ol
SMILESOC(CCn1ccnc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H18N2O/c21-18(16-7-3-1-4-8-16,17-9-5-2-6-10-17)11-13-20-14-12-19-15-20/h1-10,12,14-15,21H,11,13H2
InChIKeySMMCZMNOWZVODM-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.21
Rot. Bonds5

About 3-imidazol-1-yl-1,1-diphenylpropan-1-ol

3-imidazol-1-yl-1,1-diphenylpropan-1-ol (PubChem CID 24895248) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 3-imidazol-1-yl-1,1-diphenylpropan-1-ol.

Molecular Properties

Compound Name3-imidazol-1-yl-1,1-diphenylpropan-1-ol
PubChem CID24895248
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name3-imidazol-1-yl-1,1-diphenylpropan-1-ol
SMILESOC(CCn1ccnc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H18N2O/c21-18(16-7-3-1-4-8-16,17-9-5-2-6-10-17)11-13-20-14-12-19-15-20/h1-10,12,14-15,21H,11,13H2
InChIKeySMMCZMNOWZVODM-UHFFFAOYSA-N
XLogP3.21
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

alpha-(4-(2-Phenylethyl)phenyl)-1H-imidazole-1-ethanol
CID 53626
{3-[(1H-imidazol-1-yl)methyl]phenyl}methanol
CID 10397593
{4-[(1H-Imidazol-1-yl)methyl]phenyl}methanol
CID 15594569
(1-Methylimidazol-2-yl)-diphenylmethanol
CID 3113722
Bis(1-methylimidazol-2-yl)-phenylmethanol
CID 2849523
2-(1H-imidazol-1-yl)-1-phenylethanol
CID 32239
Denzimol hydrochloride
CID 53625
(1-methyl-1H-imidazol-2-yl)(phenyl)methanol
CID 2859379
4''-(1H-Imidazol-1-yl-propyl)-biphenyl-4-ol
CID 42642716
rac-4''-(1-Imidazol-1-yl-propyl)-biphenyl-3-ol
CID 42642717
1-(2-Hydroxy-4-phenylbutyl)imidazole
CID 13457355
1-Imidazol-1-yl-4-phenylbutan-2-ol;hydrochloride
CID 25143490

Frequently Asked Questions

What is the IUPAC name of 3-imidazol-1-yl-1,1-diphenylpropan-1-ol?
The IUPAC name of 3-imidazol-1-yl-1,1-diphenylpropan-1-ol (CID 24895248) is 3-imidazol-1-yl-1,1-diphenylpropan-1-ol.
What is the SMILES notation for 3-imidazol-1-yl-1,1-diphenylpropan-1-ol?
The canonical SMILES for 3-imidazol-1-yl-1,1-diphenylpropan-1-ol is OC(CCn1ccnc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-imidazol-1-yl-1,1-diphenylpropan-1-ol?
The InChIKey is SMMCZMNOWZVODM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c21-18(16-7-3-1-4-8-16,17-9-5-2-6-10-17)11-13-20-14-12-19-15-20/h1-10,12,14-15,21H,11,13H2.
What are the key properties of 3-imidazol-1-yl-1,1-diphenylpropan-1-ol?
3-imidazol-1-yl-1,1-diphenylpropan-1-ol has a molecular weight of 278.36 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-imidazol-1-yl-1,1-diphenylpropan-1-ol is sourced from PubChem (CID 24895248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).