N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide

C15H19N3O — CID 19281528

IUPACN-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
SMILESCCc1ccc(NC(=O)c2c(C)nn(C)c2C)cc1
InChIInChI=1S/C15H19N3O/c1-5-12-6-8-13(9-7-12)16-15(19)14-10(2)17-18(4)11(14)3/h6-9H,5H2,1-4H3,(H,16,19)
InChIKeyUYTGLISYWNKRHT-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.85
Rot. Bonds3

About N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide

N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide (PubChem CID 19281528) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
PubChem CID19281528
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
SMILESCCc1ccc(NC(=O)c2c(C)nn(C)c2C)cc1
InChIInChI=1S/C15H19N3O/c1-5-12-6-8-13(9-7-12)16-15(19)14-10(2)17-18(4)11(14)3/h6-9H,5H2,1-4H3,(H,16,19)
InChIKeyUYTGLISYWNKRHT-UHFFFAOYSA-N
XLogP2.85
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(aminomethyl)phenyl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 28742269
1,3,5-trimethyl-N-phenylpyrazole-4-carboxamide
CID 19281566
(4-ethylphenyl)-(1,3,5-trimethylpyrazol-4-yl)methanone
CID 113222398
N-[1-[(4-ethylphenoxy)methyl]pyrazol-4-yl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 19281724
2-fluoro-4-[(1,3,5-trimethylpyrazole-4-carbonyl)amino]benzoic acid
CID 103791455
(E)-N-(4-ethylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enamide
CID 26697174
N-[3-(chloromethyl)phenyl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 114293235
N-(3,4-dimethoxyphenyl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 36763541
2-[3-[(1,3,5-trimethylpyrazole-4-carbonyl)amino]phenyl]acetic acid
CID 65345706
N-[3-(butanoylamino)phenyl]-1,3,5-trimethylpyrazole-4-carboxamide
CID 87026220
1,3,5-trimethyl-N-(1-methylpyrazol-4-yl)pyrazole-4-carboxamide
CID 32607033
N-(1,3-benzodioxol-5-yl)-1,3,5-trimethylpyrazole-4-carboxamide
CID 17439489

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide?
The IUPAC name of N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide (CID 19281528) is N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide.
What is the SMILES notation for N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide?
The canonical SMILES for N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide is CCc1ccc(NC(=O)c2c(C)nn(C)c2C)cc1.
What is the InChIKey of N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide?
The InChIKey is UYTGLISYWNKRHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-5-12-6-8-13(9-7-12)16-15(19)14-10(2)17-18(4)11(14)3/h6-9H,5H2,1-4H3,(H,16,19).
What are the key properties of N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide?
N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide has a molecular weight of 257.34 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-1,3,5-trimethylpyrazole-4-carboxamide is sourced from PubChem (CID 19281528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).