(1-ethylbenzimidazol-2-yl)methanol

C10H12N2O — CID 799599

IUPAC(1-ethylbenzimidazol-2-yl)methanol
SMILESCCn1c(CO)nc2ccccc21
InChIInChI=1S/C10H12N2O/c1-2-12-9-6-4-3-5-8(9)11-10(12)7-13/h3-6,13H,2,7H2,1H3
InChIKeyYPMCFIDLEKUBHI-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.55
Rot. Bonds2

About (1-ethylbenzimidazol-2-yl)methanol

(1-ethylbenzimidazol-2-yl)methanol (PubChem CID 799599) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is (1-ethylbenzimidazol-2-yl)methanol.

Molecular Properties

Compound Name(1-ethylbenzimidazol-2-yl)methanol
PubChem CID799599
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name(1-ethylbenzimidazol-2-yl)methanol
SMILESCCn1c(CO)nc2ccccc21
InChIInChI=1S/C10H12N2O/c1-2-12-9-6-4-3-5-8(9)11-10(12)7-13/h3-6,13H,2,7H2,1H3
InChIKeyYPMCFIDLEKUBHI-UHFFFAOYSA-N
XLogP1.55
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Emedastine
CID 3219
3-(1H-1,3-benzodiazol-1-yl)propanoic acid
CID 748256
1-ethyl-1H-1,3-benzodiazol-2-amine
CID 595193
2-(Hydroxymethyl)-1H-benzimidazole
CID 78569
1-methyl-2-(methylsulfanyl)-1H-1,3-benzodiazole
CID 415665
1-Phenyl-1H-benzoimidazole
CID 606669
Ethanol, 1-(1-methyl-2-benzimidazolyl)-
CID 97831
2-Benzimidazolepropanol
CID 75470
Benzimidazole-2-carboxaldehyde, 1-methyl-, oxime
CID 135531459
2-Amino-1-methylbenzimidazole
CID 74187
1H-Benzimidazole-1-methanol
CID 146489
(1-methyl-1H-1,3-benzodiazol-2-yl)methanol
CID 344177

Frequently Asked Questions

What is the IUPAC name of (1-ethylbenzimidazol-2-yl)methanol?
The IUPAC name of (1-ethylbenzimidazol-2-yl)methanol (CID 799599) is (1-ethylbenzimidazol-2-yl)methanol.
What is the SMILES notation for (1-ethylbenzimidazol-2-yl)methanol?
The canonical SMILES for (1-ethylbenzimidazol-2-yl)methanol is CCn1c(CO)nc2ccccc21.
What is the InChIKey of (1-ethylbenzimidazol-2-yl)methanol?
The InChIKey is YPMCFIDLEKUBHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-2-12-9-6-4-3-5-8(9)11-10(12)7-13/h3-6,13H,2,7H2,1H3.
What are the key properties of (1-ethylbenzimidazol-2-yl)methanol?
(1-ethylbenzimidazol-2-yl)methanol has a molecular weight of 176.22 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylbenzimidazol-2-yl)methanol is sourced from PubChem (CID 799599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).