1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide

C15H17N5O — CID 19280706

IUPAC1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide
SMILESCCn1ncc(C(=O)Nc2nc3ccccc3n2C)c1C
InChIInChI=1S/C15H17N5O/c1-4-20-10(2)11(9-16-20)14(21)18-15-17-12-7-5-6-8-13(12)19(15)3/h5-9H,4H2,1-3H3,(H,17,18,21)
InChIKeyMVHHQIGSXPFQIY-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.35
Rot. Bonds3

About 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide

1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide (PubChem CID 19280706) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide
PubChem CID19280706
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC Name1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide
SMILESCCn1ncc(C(=O)Nc2nc3ccccc3n2C)c1C
InChIInChI=1S/C15H17N5O/c1-4-20-10(2)11(9-16-20)14(21)18-15-17-12-7-5-6-8-13(12)19(15)3/h5-9H,4H2,1-3H3,(H,17,18,21)
InChIKeyMVHHQIGSXPFQIY-UHFFFAOYSA-N
XLogP2.35
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-[2-(diethylamino)ethyl]benzimidazol-2-yl]-1-ethyl-5-methylpyrazole-4-carboxamide
CID 19280672
2-(1,5-dimethylpyrazol-4-yl)-N-(1-methylbenzimidazol-2-yl)quinoline-4-carboxamide
CID 19512369
2,5-dimethyl-N-(1-methylbenzimidazol-2-yl)pyrazole-3-carboxamide
CID 19481245
2,4-dimethyl-N-(1-methylbenzimidazol-2-yl)-1,3-oxazole-5-carboxamide
CID 10333328
N-(2-cyanophenyl)-1-ethyl-5-methylpyrazole-4-carboxamide
CID 19280815
1-methyl-N-(1-methylbenzimidazol-2-yl)triazole-4-carboxamide
CID 110471540
N-(1-ethylbenzimidazol-2-yl)-2-iodobenzamide
CID 27897993
N-(1-ethylbenzimidazol-2-yl)-6-methylpyridine-2-carboxamide
CID 46540923
1-methyl-N-(1-methylbenzimidazol-2-yl)-4-nitropyrazole-5-carboxamide
CID 19580199
N-(1-methylbenzimidazol-2-yl)-4-phenoxybenzamide
CID 72725713
3-amino-N-(1-methylbenzimidazol-2-yl)benzamide
CID 110474422
2-chloro-N-(1-methylbenzimidazol-2-yl)-4-methylsulfonylbenzamide
CID 23938449

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide?
The IUPAC name of 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide (CID 19280706) is 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide?
The canonical SMILES for 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide is CCn1ncc(C(=O)Nc2nc3ccccc3n2C)c1C.
What is the InChIKey of 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide?
The InChIKey is MVHHQIGSXPFQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-4-20-10(2)11(9-16-20)14(21)18-15-17-12-7-5-6-8-13(12)19(15)3/h5-9H,4H2,1-3H3,(H,17,18,21).
What are the key properties of 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide?
1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-methyl-N-(1-methylbenzimidazol-2-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 19280706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).