2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole

C13H14N2O — CID 816799

IUPAC2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole
SMILESCN1c2ccccc2N(C)C1c1ccco1
InChIInChI=1S/C13H14N2O/c1-14-10-6-3-4-7-11(10)15(2)13(14)12-8-5-9-16-12/h3-9,13H,1-2H3
InChIKeyLHOWBYRIBZUJDM-UHFFFAOYSA-N
MW214.27 g/mol
LogP2.86
Rot. Bonds1

About 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole

2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole (PubChem CID 816799) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole.

Molecular Properties

Compound Name2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole
PubChem CID816799
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole
SMILESCN1c2ccccc2N(C)C1c1ccco1
InChIInChI=1S/C13H14N2O/c1-14-10-6-3-4-7-11(10)15(2)13(14)12-8-5-9-16-12/h3-9,13H,1-2H3
InChIKeyLHOWBYRIBZUJDM-UHFFFAOYSA-N
XLogP2.86
TPSA19.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole?
The IUPAC name of 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole (CID 816799) is 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole.
What is the SMILES notation for 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole?
The canonical SMILES for 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole is CN1c2ccccc2N(C)C1c1ccco1.
What is the InChIKey of 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole?
The InChIKey is LHOWBYRIBZUJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-14-10-6-3-4-7-11(10)15(2)13(14)12-8-5-9-16-12/h3-9,13H,1-2H3.
What are the key properties of 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole?
2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole has a molecular weight of 214.27 g/mol, XLogP of 2.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-1,3-dimethyl-2H-benzimidazole is sourced from PubChem (CID 816799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).