N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide

C18H22FN3O — CID 46105451

IUPACN-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide
SMILESCCn1nc(-c2cccc(F)c2)cc1C(=O)NC1CCCCC1
InChIInChI=1S/C18H22FN3O/c1-2-22-17(18(23)20-15-9-4-3-5-10-15)12-16(21-22)13-7-6-8-14(19)11-13/h6-8,11-12,15H,2-5,9-10H2,1H3,(H,20,23)
InChIKeyHSBKMMXOAYMCRO-UHFFFAOYSA-N
MW315.39 g/mol
LogP3.77
Rot. Bonds4

About N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide

N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide (PubChem CID 46105451) has the molecular formula C18H22FN3O and a molecular weight of 315.39 g/mol. Its IUPAC name is N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide
PubChem CID46105451
Molecular FormulaC18H22FN3O
Molecular Weight315.39 g/mol
Exact Mass315.17
IUPAC NameN-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide
SMILESCCn1nc(-c2cccc(F)c2)cc1C(=O)NC1CCCCC1
InChIInChI=1S/C18H22FN3O/c1-2-22-17(18(23)20-15-9-4-3-5-10-15)12-16(21-22)13-7-6-8-14(19)11-13/h6-8,11-12,15H,2-5,9-10H2,1H3,(H,20,23)
InChIKeyHSBKMMXOAYMCRO-UHFFFAOYSA-N
XLogP3.77
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(2S)-butan-2-yl]-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide
CID 93014221
1-ethyl-3-(3-fluorophenyl)-N-(2-phenylethyl)pyrazole-5-carboxamide
CID 46105456
N-cyclohexyl-1-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrazole-5-carboxamide
CID 4266674
N-cyclohexyl-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
CID 46472289
N-cyclopropyl-1-ethyl-3-thiophen-3-ylpyrazole-5-carboxamide
CID 42879294
5-(cyclobutylcarbamoyl)-1-ethylpyrazole-3-carboxylic acid
CID 117218440
N-(cyclohexylmethyl)-3-(3,4-difluorophenyl)-1-ethylpyrazole-5-carboxamide
CID 46105464
N-cyclopentyl-6-(3-fluorophenyl)-1-methylpyrazolo[5,4-b]pyridine-4-carboxamide
CID 134803305
N-cyclohexyl-1-ethyl-5-[3-(trifluoromethyl)phenyl]pyrazole-3-carboxamide
CID 46104689
1-ethyl-3-(3-fluorophenyl)pyrazol-5-amine
CID 61265903
N-cyclobutyl-5-(3-fluorophenyl)-1,2-oxazole-3-carboxamide
CID 144981703
N-cyclopentyl-3-[2-(3-fluorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]propanamide
CID 20863151

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide?
The IUPAC name of N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide (CID 46105451) is N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide?
The canonical SMILES for N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide is CCn1nc(-c2cccc(F)c2)cc1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide?
The InChIKey is HSBKMMXOAYMCRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22FN3O/c1-2-22-17(18(23)20-15-9-4-3-5-10-15)12-16(21-22)13-7-6-8-14(19)11-13/h6-8,11-12,15H,2-5,9-10H2,1H3,(H,20,23).
What are the key properties of N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide?
N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide has a molecular weight of 315.39 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-ethyl-3-(3-fluorophenyl)pyrazole-5-carboxamide is sourced from PubChem (CID 46105451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).