2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide

C13H15N3O — CID 19405127

IUPAC2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide
SMILESCc1ccc(C(=O)Nc2ccn(C)n2)c(C)c1
InChIInChI=1S/C13H15N3O/c1-9-4-5-11(10(2)8-9)13(17)14-12-6-7-16(3)15-12/h4-8H,1-3H3,(H,14,15,17)
InChIKeyHZSDPECNJUZKCC-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.29
Rot. Bonds2

About 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide

2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide (PubChem CID 19405127) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide
PubChem CID19405127
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide
SMILESCc1ccc(C(=O)Nc2ccn(C)n2)c(C)c1
InChIInChI=1S/C13H15N3O/c1-9-4-5-11(10(2)8-9)13(17)14-12-6-7-16(3)15-12/h4-8H,1-3H3,(H,14,15,17)
InChIKeyHZSDPECNJUZKCC-UHFFFAOYSA-N
XLogP2.29
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-(1-methylpyrazol-3-yl)benzamide
CID 4865337
5-bromo-2-methyl-N-(1-methylpyrazol-3-yl)benzamide
CID 65307280
2,4-dimethyl-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]benzamide
CID 19284921
1,3-dimethyl-N-(1-methylpyrazol-3-yl)pyrazole-4-carboxamide
CID 19474955
N-(6-bromo-2-pyridinyl)-2,4-dimethylbenzamide
CID 43520367
5-amino-2-methyl-N-(1-methylpyrazol-3-yl)pyridine-3-carboxamide
CID 54917547
5-amino-2-methoxy-N-(1-methylpyrazol-3-yl)benzamide
CID 61104250
N-(6-chloropyridazin-3-yl)-2,4-dimethylbenzamide
CID 115608616
2-chloro-5-(2,5-dimethylpyrrol-1-yl)-N-(1-methylpyrazol-3-yl)benzamide
CID 24627356
2,4-dimethyl-N-(1-methyl-4-sulfamoylpyrazol-3-yl)benzamide
CID 61129233
6-chloro-2-methyl-N-(1-methylpyrazol-3-yl)pyrimidine-4-carboxamide
CID 75538764
2-[(2-fluorobenzoyl)amino]-3-methyl-N-(1-methylpyrazol-3-yl)benzamide
CID 71938716

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide?
The IUPAC name of 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide (CID 19405127) is 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide.
What is the SMILES notation for 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide?
The canonical SMILES for 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide is Cc1ccc(C(=O)Nc2ccn(C)n2)c(C)c1.
What is the InChIKey of 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide?
The InChIKey is HZSDPECNJUZKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-9-4-5-11(10(2)8-9)13(17)14-12-6-7-16(3)15-12/h4-8H,1-3H3,(H,14,15,17).
What are the key properties of 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide?
2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide has a molecular weight of 229.28 g/mol, XLogP of 2.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(1-methylpyrazol-3-yl)benzamide is sourced from PubChem (CID 19405127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).