5-methoxy-1-phenylbenzimidazol-4-ol

C14H12N2O2 — CID 5328518

IUPAC5-methoxy-1-phenylbenzimidazol-4-ol
SMILESCOc1ccc2c(ncn2-c2ccccc2)c1O
InChIInChI=1S/C14H12N2O2/c1-18-12-8-7-11-13(14(12)17)15-9-16(11)10-5-3-2-4-6-10/h2-9,17H,1H3
InChIKeyBCVANXGROSBZPI-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.74
Rot. Bonds2

About 5-methoxy-1-phenylbenzimidazol-4-ol

5-methoxy-1-phenylbenzimidazol-4-ol (PubChem CID 5328518) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 5-methoxy-1-phenylbenzimidazol-4-ol.

Molecular Properties

Compound Name5-methoxy-1-phenylbenzimidazol-4-ol
PubChem CID5328518
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name5-methoxy-1-phenylbenzimidazol-4-ol
SMILESCOc1ccc2c(ncn2-c2ccccc2)c1O
InChIInChI=1S/C14H12N2O2/c1-18-12-8-7-11-13(14(12)17)15-9-16(11)10-5-3-2-4-6-10/h2-9,17H,1H3
InChIKeyBCVANXGROSBZPI-UHFFFAOYSA-N
XLogP2.74
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-Methoxy-1-phenyl-1H-benzimidazole
CID 652633
1-Phenyl-5-hydroxybenzimidazole
CID 667662
1H-Benzimidazole, 5-methoxy-1-phenyl-
CID 5328466
5-ethoxy-1-phenyl-1H-1,3-benzodiazole
CID 5328497
1-phenyl-5-propoxy-1H-1,3-benzodiazole
CID 5328498
1-phenyl-5-(prop-2-en-1-yloxy)-1H-1,3-benzodiazole
CID 5328501
4-[(1-phenyl-1H-1,3-benzodiazol-5-yl)oxy]butan-1-ol
CID 5328502
5-(2,3-Epoxypropoxy)-1-phenylbenzimidazole
CID 5328503
3-[(1-phenyl-1H-1,3-benzodiazol-5-yl)oxy]propane-1,2-diol
CID 5328504
dimethyl({3-[(1-phenyl-1H-1,3-benzodiazol-5-yl)oxy]propyl})amine
CID 5328507
dimethyl({4-[(1-phenyl-1H-1,3-benzodiazol-5-yl)oxy]butyl})amine
CID 5328508
5-Substituted 1-Phenylbenzimidazole 19
CID 5328509

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-phenylbenzimidazol-4-ol?
The IUPAC name of 5-methoxy-1-phenylbenzimidazol-4-ol (CID 5328518) is 5-methoxy-1-phenylbenzimidazol-4-ol.
What is the SMILES notation for 5-methoxy-1-phenylbenzimidazol-4-ol?
The canonical SMILES for 5-methoxy-1-phenylbenzimidazol-4-ol is COc1ccc2c(ncn2-c2ccccc2)c1O.
What is the InChIKey of 5-methoxy-1-phenylbenzimidazol-4-ol?
The InChIKey is BCVANXGROSBZPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c1-18-12-8-7-11-13(14(12)17)15-9-16(11)10-5-3-2-4-6-10/h2-9,17H,1H3.
What are the key properties of 5-methoxy-1-phenylbenzimidazol-4-ol?
5-methoxy-1-phenylbenzimidazol-4-ol has a molecular weight of 240.26 g/mol, XLogP of 2.74, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-phenylbenzimidazol-4-ol is sourced from PubChem (CID 5328518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).