5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide

C18H18N4O — CID 15944175

IUPAC5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2cccc(C)c2)cnn1-c1ccccn1
InChIInChI=1S/C18H18N4O/c1-3-16-15(12-20-22(16)17-9-4-5-10-19-17)18(23)21-14-8-6-7-13(2)11-14/h4-12H,3H2,1-2H3,(H,21,23)
InChIKeyHNJFCMAIQBUAMJ-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.39
Rot. Bonds4

About 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide

5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 15944175) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID15944175
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC Name5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2cccc(C)c2)cnn1-c1ccccn1
InChIInChI=1S/C18H18N4O/c1-3-16-15(12-20-22(16)17-9-4-5-10-19-17)18(23)21-14-8-6-7-13(2)11-14/h4-12H,3H2,1-2H3,(H,21,23)
InChIKeyHNJFCMAIQBUAMJ-UHFFFAOYSA-N
XLogP3.39
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethyl-N-(3-hydroxyphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 91885720
N-(3-ethylphenyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 15944134
5-ethyl-N-(2-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 15944173
5-ethyl-N-(3-methyl-4-pyrrolidin-1-ylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 55827653
5-ethyl-N-(5-fluoro-2-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide
CID 91885724
propan-2-yl 4-[(5-ethyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]benzoate
CID 91885717
ethyl 2-[(5-ethyl-1-pyridin-2-ylpyrazole-4-carbonyl)amino]benzoate
CID 15944198
5-ethyl-1-pyridin-2-yl-N-[4-(pyrrolidine-1-carbonyl)phenyl]pyrazole-4-carboxamide
CID 55604055
N-(2-tert-butyl-1,3-benzoxazol-5-yl)-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 38332153
N-(4-cyclopentylsulfanylphenyl)-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 38021535
5-ethyl-N'-[2-(4-methylphenoxy)acetyl]-1-pyridin-2-ylpyrazole-4-carbohydrazide
CID 78867900
5-ethyl-N-[3-(methylamino)propyl]-1-pyridin-2-ylpyrazole-4-carboxamide
CID 119433437

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide (CID 15944175) is 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide is CCc1c(C(=O)Nc2cccc(C)c2)cnn1-c1ccccn1.
What is the InChIKey of 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is HNJFCMAIQBUAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c1-3-16-15(12-20-22(16)17-9-4-5-10-19-17)18(23)21-14-8-6-7-13(2)11-14/h4-12H,3H2,1-2H3,(H,21,23).
What are the key properties of 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide?
5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 306.37 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(3-methylphenyl)-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 15944175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).