2-[(1-methylbenzimidazol-2-yl)methyl]phenol

C15H14N2O — CID 14452296

IUPAC2-[(1-methylbenzimidazol-2-yl)methyl]phenol
SMILESCn1c(Cc2ccccc2O)nc2ccccc21
InChIInChI=1S/C15H14N2O/c1-17-13-8-4-3-7-12(13)16-15(17)10-11-6-2-5-9-14(11)18/h2-9,18H,10H2,1H3
InChIKeyMGWHICDVYHPLLO-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.87
Rot. Bonds2

About 2-[(1-methylbenzimidazol-2-yl)methyl]phenol

2-[(1-methylbenzimidazol-2-yl)methyl]phenol (PubChem CID 14452296) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 2-[(1-methylbenzimidazol-2-yl)methyl]phenol.

Molecular Properties

Compound Name2-[(1-methylbenzimidazol-2-yl)methyl]phenol
PubChem CID14452296
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name2-[(1-methylbenzimidazol-2-yl)methyl]phenol
SMILESCn1c(Cc2ccccc2O)nc2ccccc21
InChIInChI=1S/C15H14N2O/c1-17-13-8-4-3-7-12(13)16-15(17)10-11-6-2-5-9-14(11)18/h2-9,18H,10H2,1H3
InChIKeyMGWHICDVYHPLLO-UHFFFAOYSA-N
XLogP2.87
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-fluoro-2-[(1-methylbenzimidazol-2-yl)methyl]phenol
CID 83130766
4-fluoro-2-[(1-methylbenzimidazol-2-yl)methyl]phenol
CID 83129949
2-fluoro-4-[(1-methylbenzimidazol-2-yl)methyl]phenol
CID 83130260
2-fluoro-6-[(1-methylbenzimidazol-2-yl)methyl]aniline
CID 107602854
2-fluoro-6-[(1-methylbenzimidazol-2-yl)methyl]benzoic acid
CID 114560340
2-(iodomethyl)-1-methylbenzimidazole
CID 20803299
1-methyl-2-[4-(1-methylbenzimidazol-2-yl)butyl]benzimidazole
CID 171320881
2-(1-methylbenzimidazol-2-yl)ethanamine;dihydrochloride
CID 45075160
3-methyl-4-[(1-methylbenzimidazol-2-yl)methyl]aniline
CID 79753807
3-(1-methylbenzimidazol-2-yl)propan-1-ol
CID 4585215
1-(1-methylbenzimidazol-2-yl)-3-(2-methylphenyl)propan-2-one
CID 79755659
N-[[3-[(1-methylbenzimidazol-2-yl)methyl]furan-2-yl]methyl]ethanamine
CID 106887581

Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylbenzimidazol-2-yl)methyl]phenol?
The IUPAC name of 2-[(1-methylbenzimidazol-2-yl)methyl]phenol (CID 14452296) is 2-[(1-methylbenzimidazol-2-yl)methyl]phenol.
What is the SMILES notation for 2-[(1-methylbenzimidazol-2-yl)methyl]phenol?
The canonical SMILES for 2-[(1-methylbenzimidazol-2-yl)methyl]phenol is Cn1c(Cc2ccccc2O)nc2ccccc21.
What is the InChIKey of 2-[(1-methylbenzimidazol-2-yl)methyl]phenol?
The InChIKey is MGWHICDVYHPLLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-17-13-8-4-3-7-12(13)16-15(17)10-11-6-2-5-9-14(11)18/h2-9,18H,10H2,1H3.
What are the key properties of 2-[(1-methylbenzimidazol-2-yl)methyl]phenol?
2-[(1-methylbenzimidazol-2-yl)methyl]phenol has a molecular weight of 238.29 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylbenzimidazol-2-yl)methyl]phenol is sourced from PubChem (CID 14452296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).