N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide

C18H18N4O — CID 46481510

IUPACN-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCN(C(=O)c1cnn(-c2ccccn2)c1C)c1ccccc1
InChIInChI=1S/C18H18N4O/c1-3-21(15-9-5-4-6-10-15)18(23)16-13-20-22(14(16)2)17-11-7-8-12-19-17/h4-13H,3H2,1-2H3
InChIKeyUYUDBQNUVKAERT-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.24
Rot. Bonds4

About N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide

N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 46481510) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID46481510
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC NameN-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCN(C(=O)c1cnn(-c2ccccn2)c1C)c1ccccc1
InChIInChI=1S/C18H18N4O/c1-3-21(15-9-5-4-6-10-15)18(23)16-13-20-22(14(16)2)17-11-7-8-12-19-17/h4-13H,3H2,1-2H3
InChIKeyUYUDBQNUVKAERT-UHFFFAOYSA-N
XLogP3.24
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(N-methylanilino)-2-oxoethyl] 5-methyl-1-pyridin-2-ylpyrazole-4-carboxylate
CID 55629523
N-ethyl-5-methyl-N-phenyl-1-[3-(trifluoromethyl)phenyl]pyrazole-4-carboxamide
CID 55513631
5-methyl-1-pyridin-2-ylpyrazole-4-carbohydrazide
CID 10998462
ethyl 2-[benzyl-(5-methyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]acetate
CID 86852495
5-[ethyl(phenyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid
CID 19623720
N-(2-aminoethyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 108793385
5-methyl-N-octyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 108793376
2-[[2-[(5-methyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]acetyl]amino]acetic acid
CID 108793421
ethyl 2-[(5-methyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]-2-phenylacetate
CID 108805316
N-butan-2-yl-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 108793345
(3,5-dimethylpyrazol-1-yl)-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)methanone
CID 15944096
N-[2-(diethylamino)-2-thiophen-3-ylethyl]-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 60510440

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide (CID 46481510) is N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide is CCN(C(=O)c1cnn(-c2ccccn2)c1C)c1ccccc1.
What is the InChIKey of N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is UYUDBQNUVKAERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c1-3-21(15-9-5-4-6-10-15)18(23)16-13-20-22(14(16)2)17-11-7-8-12-19-17/h4-13H,3H2,1-2H3.
What are the key properties of N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide?
N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-N-phenyl-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 46481510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).