(1,2-dimethylbenzimidazol-5-yl)methanol

C10H12N2O — CID 2998315

IUPAC(1,2-dimethylbenzimidazol-5-yl)methanol
SMILESCc1nc2cc(CO)ccc2n1C
InChIInChI=1S/C10H12N2O/c1-7-11-9-5-8(6-13)3-4-10(9)12(7)2/h3-5,13H,6H2,1-2H3
InChIKeyDTWCONPNVHZPJS-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.37
Rot. Bonds1

About (1,2-dimethylbenzimidazol-5-yl)methanol

(1,2-dimethylbenzimidazol-5-yl)methanol (PubChem CID 2998315) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is (1,2-dimethylbenzimidazol-5-yl)methanol.

Molecular Properties

Compound Name(1,2-dimethylbenzimidazol-5-yl)methanol
PubChem CID2998315
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name(1,2-dimethylbenzimidazol-5-yl)methanol
SMILESCc1nc2cc(CO)ccc2n1C
InChIInChI=1S/C10H12N2O/c1-7-11-9-5-8(6-13)3-4-10(9)12(7)2/h3-5,13H,6H2,1-2H3
InChIKeyDTWCONPNVHZPJS-UHFFFAOYSA-N
XLogP1.37
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1,2-dimethylbenzimidazol-5-yl)methanol?
The IUPAC name of (1,2-dimethylbenzimidazol-5-yl)methanol (CID 2998315) is (1,2-dimethylbenzimidazol-5-yl)methanol.
What is the SMILES notation for (1,2-dimethylbenzimidazol-5-yl)methanol?
The canonical SMILES for (1,2-dimethylbenzimidazol-5-yl)methanol is Cc1nc2cc(CO)ccc2n1C.
What is the InChIKey of (1,2-dimethylbenzimidazol-5-yl)methanol?
The InChIKey is DTWCONPNVHZPJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-7-11-9-5-8(6-13)3-4-10(9)12(7)2/h3-5,13H,6H2,1-2H3.
What are the key properties of (1,2-dimethylbenzimidazol-5-yl)methanol?
(1,2-dimethylbenzimidazol-5-yl)methanol has a molecular weight of 176.22 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dimethylbenzimidazol-5-yl)methanol is sourced from PubChem (CID 2998315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).