5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide

C15H18N4O2 — CID 78901950

IUPAC5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide
SMILESCCNC(=O)c1ccc(NC(=O)c2cc(CC)[nH]n2)cc1
InChIInChI=1S/C15H18N4O2/c1-3-11-9-13(19-18-11)15(21)17-12-7-5-10(6-8-12)14(20)16-4-2/h5-9H,3-4H2,1-2H3,(H,16,20)(H,17,21)(H,18,19)
InChIKeyPPPPUPGVZWZCTD-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.97
Rot. Bonds5

About 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide

5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide (PubChem CID 78901950) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide
PubChem CID78901950
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide
SMILESCCNC(=O)c1ccc(NC(=O)c2cc(CC)[nH]n2)cc1
InChIInChI=1S/C15H18N4O2/c1-3-11-9-13(19-18-11)15(21)17-12-7-5-10(6-8-12)14(20)16-4-2/h5-9H,3-4H2,1-2H3,(H,16,20)(H,17,21)(H,18,19)
InChIKeyPPPPUPGVZWZCTD-UHFFFAOYSA-N
XLogP1.97
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(ethylcarbamoyl)phenyl]methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 87045448
[4-(ethylcarbamoyl)phenyl]carbamic acid;propane
CID 142227182
4-(carbamoylamino)-N-(5-ethyl-1H-pyrazol-3-yl)benzamide
CID 115593799
N-(3,4-dimethylphenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 55555026
5-ethyl-N-(2-methyl-1,3-benzoxazol-6-yl)-1H-pyrazole-3-carboxamide
CID 86930357
4-benzamido-N-ethylbenzamide
CID 17153265
N-(4-chlorophenyl)-5-(2-methylpropyl)-1H-pyrazole-3-carboxamide
CID 55741644
6-bromo-N-[4-(ethylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 103875193
4-[(2-ethoxyacetyl)amino]-N-ethylbenzamide
CID 60793697
N-(3-acetamidophenyl)-5-propyl-1H-pyrazole-3-carboxamide
CID 36709127
N-[4-(diethylamino)phenyl]-5-(2-methylpropyl)-1H-pyrazole-3-carboxamide
CID 55910471
N-ethyl-4-[(4-methylsulfanylbenzoyl)amino]benzamide
CID 78892378

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide?
The IUPAC name of 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide (CID 78901950) is 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide.
What is the SMILES notation for 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide?
The canonical SMILES for 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide is CCNC(=O)c1ccc(NC(=O)c2cc(CC)[nH]n2)cc1.
What is the InChIKey of 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide?
The InChIKey is PPPPUPGVZWZCTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-3-11-9-13(19-18-11)15(21)17-12-7-5-10(6-8-12)14(20)16-4-2/h5-9H,3-4H2,1-2H3,(H,16,20)(H,17,21)(H,18,19).
What are the key properties of 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide?
5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.97, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-[4-(ethylcarbamoyl)phenyl]-1H-pyrazole-3-carboxamide is sourced from PubChem (CID 78901950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).