N,N,1-trimethylbenzimidazole-2-carboxamide

C11H13N3O — CID 44590949

IUPACN,N,1-trimethylbenzimidazole-2-carboxamide
SMILESCN(C)C(=O)c1nc2ccccc2n1C
InChIInChI=1S/C11H13N3O/c1-13(2)11(15)10-12-8-6-4-5-7-9(8)14(10)3/h4-7H,1-3H3
InChIKeyVYFOWMOGXILCST-UHFFFAOYSA-N
MW203.24 g/mol
LogP1.28
Rot. Bonds1

About N,N,1-trimethylbenzimidazole-2-carboxamide

N,N,1-trimethylbenzimidazole-2-carboxamide (PubChem CID 44590949) has the molecular formula C11H13N3O and a molecular weight of 203.24 g/mol. Its IUPAC name is N,N,1-trimethylbenzimidazole-2-carboxamide.

Molecular Properties

Compound NameN,N,1-trimethylbenzimidazole-2-carboxamide
PubChem CID44590949
Molecular FormulaC11H13N3O
Molecular Weight203.24 g/mol
Exact Mass203.11
IUPAC NameN,N,1-trimethylbenzimidazole-2-carboxamide
SMILESCN(C)C(=O)c1nc2ccccc2n1C
InChIInChI=1S/C11H13N3O/c1-13(2)11(15)10-12-8-6-4-5-7-9(8)14(10)3/h4-7H,1-3H3
InChIKeyVYFOWMOGXILCST-UHFFFAOYSA-N
XLogP1.28
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,1-trimethylbenzimidazole-2-carboxamide?
The IUPAC name of N,N,1-trimethylbenzimidazole-2-carboxamide (CID 44590949) is N,N,1-trimethylbenzimidazole-2-carboxamide.
What is the SMILES notation for N,N,1-trimethylbenzimidazole-2-carboxamide?
The canonical SMILES for N,N,1-trimethylbenzimidazole-2-carboxamide is CN(C)C(=O)c1nc2ccccc2n1C.
What is the InChIKey of N,N,1-trimethylbenzimidazole-2-carboxamide?
The InChIKey is VYFOWMOGXILCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-13(2)11(15)10-12-8-6-4-5-7-9(8)14(10)3/h4-7H,1-3H3.
What are the key properties of N,N,1-trimethylbenzimidazole-2-carboxamide?
N,N,1-trimethylbenzimidazole-2-carboxamide has a molecular weight of 203.24 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1-trimethylbenzimidazole-2-carboxamide is sourced from PubChem (CID 44590949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).