[5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol

C16H17N3O — CID 163530387

IUPAC[5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol
SMILESCC(C)n1c(-c2cncc(CO)c2)nc2ccccc21
InChIInChI=1S/C16H17N3O/c1-11(2)19-15-6-4-3-5-14(15)18-16(19)13-7-12(10-20)8-17-9-13/h3-9,11,20H,10H2,1-2H3
InChIKeyDSMGHPJGPNOSGB-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.17
Rot. Bonds3

About [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol

[5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol (PubChem CID 163530387) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol
PubChem CID163530387
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name[5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol
SMILESCC(C)n1c(-c2cncc(CO)c2)nc2ccccc21
InChIInChI=1S/C16H17N3O/c1-11(2)19-15-6-4-3-5-14(15)18-16(19)13-7-12(10-20)8-17-9-13/h3-9,11,20H,10H2,1-2H3
InChIKeyDSMGHPJGPNOSGB-UHFFFAOYSA-N
XLogP3.17
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[3-(chloromethyl)phenyl]-1-propan-2-ylbenzimidazole
CID 43325834
3-(1-propan-2-ylbenzimidazol-2-yl)aniline
CID 4605444
2-amino-4-(1-propan-2-ylbenzimidazol-2-yl)phenol
CID 136872074
4-(1-propan-2-ylbenzimidazol-2-yl)benzoic acid
CID 4915596
2-[5-(imidazol-1-ylmethyl)-3-pyridinyl]-6-iodo-1-propan-2-ylbenzimidazole
CID 118612243
5-(6-chloro-1-propan-2-ylbenzimidazol-2-yl)pyridin-3-ol
CID 115473460
5-(5-bromo-1-propan-2-ylbenzimidazol-2-yl)pyridin-3-ol
CID 63850340
5-(5-chloro-1-propan-2-ylbenzimidazol-2-yl)pyridin-3-ol
CID 63852215
2-(2,4-dimethylphenyl)-1-propan-2-ylbenzimidazole
CID 46310533
5-(6-chloro-1-propan-2-ylbenzimidazol-2-yl)pyridin-3-amine
CID 115473071
2-(1-propan-2-ylbenzimidazol-2-yl)quinolin-8-ol
CID 136859294
3-fluoro-4-(1-propan-2-ylbenzimidazol-2-yl)phenol
CID 136751548

Frequently Asked Questions

What is the IUPAC name of [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol?
The IUPAC name of [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol (CID 163530387) is [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol?
The canonical SMILES for [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol is CC(C)n1c(-c2cncc(CO)c2)nc2ccccc21.
What is the InChIKey of [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol?
The InChIKey is DSMGHPJGPNOSGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-11(2)19-15-6-4-3-5-14(15)18-16(19)13-7-12(10-20)8-17-9-13/h3-9,11,20H,10H2,1-2H3.
What are the key properties of [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol?
[5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol has a molecular weight of 267.33 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-propan-2-ylbenzimidazol-2-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 163530387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).