N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide

C19H19N3O — CID 850677

IUPACN,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide
SMILESCc1cccc(N(C)C(=O)c2cnn(-c3ccccc3)c2C)c1
InChIInChI=1S/C19H19N3O/c1-14-8-7-11-17(12-14)21(3)19(23)18-13-20-22(15(18)2)16-9-5-4-6-10-16/h4-13H,1-3H3
InChIKeyALGASVRZQCYQQI-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.77
Rot. Bonds3

About N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide

N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide (PubChem CID 850677) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide
PubChem CID850677
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC NameN,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide
SMILESCc1cccc(N(C)C(=O)c2cnn(-c3ccccc3)c2C)c1
InChIInChI=1S/C19H19N3O/c1-14-8-7-11-17(12-14)21(3)19(23)18-13-20-22(15(18)2)16-9-5-4-6-10-16/h4-13H,1-3H3
InChIKeyALGASVRZQCYQQI-UHFFFAOYSA-N
XLogP3.77
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Fluxapyroxad
CID 16095400
1,3-Diphenyl-1H-pyrazole-4-carboxaldehyde
CID 555820
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CID 2808002
1H-Pyrazole-4-carboxamide, 1,3-diphenyl-5-methyl-N-(phenylmethyl)-
CID 997622
3-(1-Phenyl-1h-Pyrazol-5-Yl)-1-[3-(Trifluoromethyl)phenyl]pyridazin-4(1h)-One
CID 46219819
5-[1-(4-Cyanophenyl)-1H-pyrazol-5-yl]-N,6-dimethyl-2-oxo-1-[3-(trifluoromethyl)phenyl]-1,2-dihydropyridine-3-carboxamide
CID 17755151
3-(4-fluorophenyl)-1-phenyl-1H-pyrazole-4-carbaldehyde
CID 700989
5-methyl-N,1-diphenylpyrazole-4-carboxamide
CID 827598
N-(2,4-difluorophenyl)-1-phenyl-5-propyl-1H-pyrazole-4-carboxamide
CID 2811411
2-methyl-2H-pyrazole-3-carboxylic acid (2-methyl-4-o-tolylazophenyl)amide
CID 3091786
N-(3-methylphenyl)-1,3-diphenyl-1H-pyrazole-4-carboxamide
CID 3510494
1-(5-Methyl-1-phenyl-1H-pyrazol-4-yl)ethan-1-one
CID 80207

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide?
The IUPAC name of N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide (CID 850677) is N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide is Cc1cccc(N(C)C(=O)c2cnn(-c3ccccc3)c2C)c1.
What is the InChIKey of N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide?
The InChIKey is ALGASVRZQCYQQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-14-8-7-11-17(12-14)21(3)19(23)18-13-20-22(15(18)2)16-9-5-4-6-10-16/h4-13H,1-3H3.
What are the key properties of N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide?
N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 850677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).