N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide

C16H19N3O — CID 42818280

IUPACN-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)NC2CC2)c(C)nn1-c1ccccc1
InChIInChI=1S/C16H19N3O/c1-3-14-15(16(20)17-12-9-10-12)11(2)18-19(14)13-7-5-4-6-8-13/h4-8,12H,3,9-10H2,1-2H3,(H,17,20)
InChIKeyRLNDZNOFPJKZFR-UHFFFAOYSA-N
MW269.35 g/mol
LogP2.64
Rot. Bonds4

About N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide

N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide (PubChem CID 42818280) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide
PubChem CID42818280
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC NameN-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)NC2CC2)c(C)nn1-c1ccccc1
InChIInChI=1S/C16H19N3O/c1-3-14-15(16(20)17-12-9-10-12)11(2)18-19(14)13-7-5-4-6-8-13/h4-8,12H,3,9-10H2,1-2H3,(H,17,20)
InChIKeyRLNDZNOFPJKZFR-UHFFFAOYSA-N
XLogP2.64
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-3-methyl-N,1-diphenylpyrazole-4-carboxamide
CID 163806603
N-cycloheptyl-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 9268507
3,5-dimethyl-N-(1-methylsulfonylpiperidin-4-yl)-1-phenylpyrazole-4-carboxamide
CID 46566455
3,5-dimethyl-1-phenyl-N-piperidin-3-ylpyrazole-4-carboxamide;hydrochloride
CID 119424409
ethyl 4-[(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)amino]piperidine-1-carboxylate
CID 6623485
5-chloro-N-[1-(4-ethylsulfonylphenyl)piperidin-4-yl]-3-methyl-1-phenylpyrazole-4-carboxamide
CID 60602914
N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 8590207
N-[1-(furan-2-carbonyl)piperidin-4-yl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 134000256
N-(2-aminoethyl)-3,5-dimethyl-1-phenylpyrazole-4-carboxamide
CID 119382148
[4-[(3-methyl-1-phenylthieno[3,2-d]pyrazole-5-carbonyl)amino]cyclohexyl]carbamic acid
CID 66819242
5-ethyl-3-methyl-1-pyridin-3-ylpyrazole-4-carboxylic acid
CID 67119556
3,5-dimethyl-1-phenyl-N-(2-sulfanylethyl)pyrazole-4-carboxamide
CID 13170727

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide (CID 42818280) is N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide is CCc1c(C(=O)NC2CC2)c(C)nn1-c1ccccc1.
What is the InChIKey of N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide?
The InChIKey is RLNDZNOFPJKZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-3-14-15(16(20)17-12-9-10-12)11(2)18-19(14)13-7-5-4-6-8-13/h4-8,12H,3,9-10H2,1-2H3,(H,17,20).
What are the key properties of N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide?
N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide has a molecular weight of 269.35 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-ethyl-3-methyl-1-phenylpyrazole-4-carboxamide is sourced from PubChem (CID 42818280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).