2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol

C15H12N2O — CID 137201342

IUPAC2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol
SMILESOc1ccccc1C=Cc1nc2ccccc2[nH]1
InChIInChI=1S/C15H12N2O/c18-14-8-4-1-5-11(14)9-10-15-16-12-6-2-3-7-13(12)17-15/h1-10,18H,(H,16,17)
InChIKeyMJKKCMJLSCDFIU-UHFFFAOYSA-N
MW236.27 g/mol
LogP3.44
Rot. Bonds2

About 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol

2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol (PubChem CID 137201342) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol.

Molecular Properties

Compound Name2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol
PubChem CID137201342
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol
SMILESOc1ccccc1C=Cc1nc2ccccc2[nH]1
InChIInChI=1S/C15H12N2O/c18-14-8-4-1-5-11(14)9-10-15-16-12-6-2-3-7-13(12)17-15/h1-10,18H,(H,16,17)
InChIKeyMJKKCMJLSCDFIU-UHFFFAOYSA-N
XLogP3.44
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(E)-2-(1H-benzimidazol-2-yl)ethenyl]phosphane
CID 20732162
2-[(Z)-prop-1-enyl]-1H-benzimidazole
CID 6166899
2-[(E)-2-(2,4-difluorophenyl)ethenyl]-1H-benzimidazole
CID 132567925
2-[2-[2-fluoro-3-(trifluoromethyl)phenyl]ethenyl]-1H-benzimidazole
CID 141198507
3-(1H-benzimidazol-2-yl)prop-2-enoic acid
CID 4702151
2-[(E)-2-(4-methylphenyl)ethenyl]-1H-benzimidazole
CID 6048083
[(E)-2-(1H-benzimidazol-2-yl)ethenyl]phosphonic acid
CID 23453413
4-[2-(1H-benzimidazol-2-yl)ethenyl]aniline
CID 2749986
2-[(E)-2-(1H-benzimidazol-2-yl)ethenyl]-1,3-benzoxazole
CID 12820843
N-[(E)-3-(1H-benzimidazol-2-yl)prop-2-enoyl]-2-hydroxybenzamide
CID 751752
4-[2-(1H-benzimidazol-2-yl)ethenyl]-1,2-oxazole
CID 67417408
2-[(E)-2-(5-bromo-2-hydroxyphenyl)ethenyl]-3H-quinazolin-4-one
CID 135514039

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol?
The IUPAC name of 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol (CID 137201342) is 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol.
What is the SMILES notation for 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol?
The canonical SMILES for 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol is Oc1ccccc1C=Cc1nc2ccccc2[nH]1.
What is the InChIKey of 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol?
The InChIKey is MJKKCMJLSCDFIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c18-14-8-4-1-5-11(14)9-10-15-16-12-6-2-3-7-13(12)17-15/h1-10,18H,(H,16,17).
What are the key properties of 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol?
2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol has a molecular weight of 236.27 g/mol, XLogP of 3.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1H-benzimidazol-2-yl)ethenyl]phenol is sourced from PubChem (CID 137201342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).