5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide

C19H19N3O — CID 71824609

IUPAC5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
SMILESCc1ccc(-c2[nH]ncc2C(=O)NCc2ccccc2C)cc1
InChIInChI=1S/C19H19N3O/c1-13-7-9-15(10-8-13)18-17(12-21-22-18)19(23)20-11-16-6-4-3-5-14(16)2/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyFVNFWYYIHXMWDS-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.62
Rot. Bonds4

About 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide

5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide (PubChem CID 71824609) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
PubChem CID71824609
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
SMILESCc1ccc(-c2[nH]ncc2C(=O)NCc2ccccc2C)cc1
InChIInChI=1S/C19H19N3O/c1-13-7-9-15(10-8-13)18-17(12-21-22-18)19(23)20-11-16-6-4-3-5-14(16)2/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyFVNFWYYIHXMWDS-UHFFFAOYSA-N
XLogP3.62
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-5-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 71824647
5-(3-methoxyphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
CID 71824347
5-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-1H-pyrazole-4-carboxamide
CID 71824606
N-[(4-fluorophenyl)methyl]-5-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 71824635
N-[(3-methoxyphenyl)methyl]-5-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 71824643
3-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-5-carboxamide
CID 51046542
5-(4-ethylphenyl)-N-[(4-ethylphenyl)methyl]-1H-pyrazole-4-carboxamide
CID 71824428
N-benzyl-5-(3-methylphenyl)-1H-pyrazole-4-carboxamide
CID 53490368
5-phenyl-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide
CID 25342036
5-(4-butoxyphenyl)-N-[(2-methoxyphenyl)methyl]-1H-pyrazole-4-carboxamide
CID 71824584
5-(4-chlorophenyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]-1H-pyrazole-4-carboxamide
CID 16600513
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-5-(4-fluorophenyl)-1H-pyrazole-4-carboxamide
CID 17438304

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide (CID 71824609) is 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide is Cc1ccc(-c2[nH]ncc2C(=O)NCc2ccccc2C)cc1.
What is the InChIKey of 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide?
The InChIKey is FVNFWYYIHXMWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-13-7-9-15(10-8-13)18-17(12-21-22-18)19(23)20-11-16-6-4-3-5-14(16)2/h3-10,12H,11H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide?
5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylphenyl)-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 71824609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).