5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide

C19H19N3O — CID 163806603

IUPAC5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2ccccc2)c(C)nn1-c1ccccc1
InChIInChI=1S/C19H19N3O/c1-3-17-18(19(23)20-15-10-6-4-7-11-15)14(2)21-22(17)16-12-8-5-9-13-16/h4-13H,3H2,1-2H3,(H,20,23)
InChIKeyNJOQDIGURBSSPR-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.00
Rot. Bonds4

About 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide

5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide (PubChem CID 163806603) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide
PubChem CID163806603
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)Nc2ccccc2)c(C)nn1-c1ccccc1
InChIInChI=1S/C19H19N3O/c1-3-17-18(19(23)20-15-10-6-4-7-11-15)14(2)21-22(17)16-12-8-5-9-13-16/h4-13H,3H2,1-2H3,(H,20,23)
InChIKeyNJOQDIGURBSSPR-UHFFFAOYSA-N
XLogP4.00
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide
CID 42818280
5-ethyl-N,1-diphenyltriazole-4-carboxamide
CID 15944220
N-(4-tert-butylphenyl)-5-chloro-3-methyl-1-phenylpyrazole-4-carboxamide
CID 26102988
5-chloro-3-methyl-N-(3-methylphenyl)-1-phenylpyrazole-4-carboxamide
CID 3132709
5-chloro-N-[4-(dimethylamino)phenyl]-3-methyl-1-phenylpyrazole-4-carboxamide
CID 78776531
N-[3-(2,2-dimethylpropanoylamino)phenyl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 55532044
N-(4-fluorophenyl)-3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carboxamide
CID 20892669
1,3,5-trimethyl-N-phenylpyrazole-4-carboxamide
CID 19281566
5-ethyl-3-methyl-1-pyridin-3-ylpyrazole-4-carboxylic acid
CID 67119556
5-ethyl-1-(4-fluorophenyl)-3-methyl-N-propan-2-ylpyrazole-4-carboxamide
CID 42818350
N-(3,4-difluorophenyl)-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 26245099
5-chloro-N-(3,4-dimethylphenyl)-3-methyl-1-phenylpyrazole-4-carboxamide
CID 680133

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide?
The IUPAC name of 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide (CID 163806603) is 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide.
What is the SMILES notation for 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide?
The canonical SMILES for 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide is CCc1c(C(=O)Nc2ccccc2)c(C)nn1-c1ccccc1.
What is the InChIKey of 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide?
The InChIKey is NJOQDIGURBSSPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-3-17-18(19(23)20-15-10-6-4-7-11-15)14(2)21-22(17)16-12-8-5-9-13-16/h4-13H,3H2,1-2H3,(H,20,23).
What are the key properties of 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide?
5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide is sourced from PubChem (CID 163806603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).