4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide

C22H24N4O2 — CID 29096951

IUPAC4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide
SMILESCc1ccc(C)c(NC(=O)c2cnn(C)c2C(=O)Nc2cc(C)ccc2C)c1
InChIInChI=1S/C22H24N4O2/c1-13-6-8-15(3)18(10-13)24-21(27)17-12-23-26(5)20(17)22(28)25-19-11-14(2)7-9-16(19)4/h6-12H,1-5H3,(H,24,27)(H,25,28)
InChIKeyQCWPQXREVQSHHR-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.16
Rot. Bonds4

About 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide

4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide (PubChem CID 29096951) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide.

Molecular Properties

Compound Name4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide
PubChem CID29096951
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide
SMILESCc1ccc(C)c(NC(=O)c2cnn(C)c2C(=O)Nc2cc(C)ccc2C)c1
InChIInChI=1S/C22H24N4O2/c1-13-6-8-15(3)18(10-13)24-21(27)17-12-23-26(5)20(17)22(28)25-19-11-14(2)7-9-16(19)4/h6-12H,1-5H3,(H,24,27)(H,25,28)
InChIKeyQCWPQXREVQSHHR-UHFFFAOYSA-N
XLogP4.16
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethylphenyl)-4-iodo-1-methylpyrazole-5-carboxamide
CID 19476120
4-N,5-N-bis(2-methoxy-5-methylphenyl)-1-methylpyrazole-4,5-dicarboxamide
CID 29096938
5-[(2-hydroxy-5-methylphenyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 25248036
4-[(2,5-dimethylbenzoyl)amino]-1-methyl-N-propylpyrazole-5-carboxamide
CID 19396369
N-(2-bromo-5-methylphenyl)-1,5-dimethylpyrazole-4-carboxamide
CID 82706059
N-(2,5-dimethylphenyl)-5-methyl-1-phenylpyrazole-4-carboxamide
CID 850670
N-(2,5-dimethylphenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 19474851
4-amino-N-(5-chloro-2-methylphenyl)-1-methylpyrazole-5-carboxamide
CID 65356207
N-(2,5-dimethylphenyl)-3-methyl-1,2-oxazole-4-carboxamide
CID 110857256
N-(2,5-dimethylphenyl)-1-methyl-6-oxo-4,5-dihydropyridazine-3-carboxamide
CID 27285275
4-chloro-N-(2-methoxy-5-methylphenyl)-1-methylpyrazole-5-carboxamide
CID 6465441
5-[(1,5-dimethylpyrazol-4-yl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 19494189

Frequently Asked Questions

What is the IUPAC name of 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide?
The IUPAC name of 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide (CID 29096951) is 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide.
What is the SMILES notation for 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide?
The canonical SMILES for 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide is Cc1ccc(C)c(NC(=O)c2cnn(C)c2C(=O)Nc2cc(C)ccc2C)c1.
What is the InChIKey of 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide?
The InChIKey is QCWPQXREVQSHHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-13-6-8-15(3)18(10-13)24-21(27)17-12-23-26(5)20(17)22(28)25-19-11-14(2)7-9-16(19)4/h6-12H,1-5H3,(H,24,27)(H,25,28).
What are the key properties of 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide?
4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,5-N-bis(2,5-dimethylphenyl)-1-methylpyrazole-4,5-dicarboxamide is sourced from PubChem (CID 29096951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).