1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide

C19H20N4O — CID 71579927

IUPAC1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide
SMILESCc1ccc(-c2c(C)c(C(=O)Nc3cccc(C)n3)nn2C)cc1
InChIInChI=1S/C19H20N4O/c1-12-8-10-15(11-9-12)18-14(3)17(22-23(18)4)19(24)21-16-7-5-6-13(2)20-16/h5-11H,1-4H3,(H,20,21,24)
InChIKeyGBQMBYCOMUWBGL-UHFFFAOYSA-N
MW320.40 g/mol
LogP3.66
Rot. Bonds3

About 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide

1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide (PubChem CID 71579927) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide
PubChem CID71579927
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide
SMILESCc1ccc(-c2c(C)c(C(=O)Nc3cccc(C)n3)nn2C)cc1
InChIInChI=1S/C19H20N4O/c1-12-8-10-15(11-9-12)18-14(3)17(22-23(18)4)19(24)21-16-7-5-6-13(2)20-16/h5-11H,1-4H3,(H,20,21,24)
InChIKeyGBQMBYCOMUWBGL-UHFFFAOYSA-N
XLogP3.66
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide?
The IUPAC name of 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide (CID 71579927) is 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide?
The canonical SMILES for 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide is Cc1ccc(-c2c(C)c(C(=O)Nc3cccc(C)n3)nn2C)cc1.
What is the InChIKey of 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide?
The InChIKey is GBQMBYCOMUWBGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O/c1-12-8-10-15(11-9-12)18-14(3)17(22-23(18)4)19(24)21-16-7-5-6-13(2)20-16/h5-11H,1-4H3,(H,20,21,24).
What are the key properties of 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide?
1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide has a molecular weight of 320.40 g/mol, XLogP of 3.66, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-5-(4-methylphenyl)-N-(6-methyl-2-pyridinyl)pyrazole-3-carboxamide is sourced from PubChem (CID 71579927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).