4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide

C13H15FN4O — CID 65354287

IUPAC4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide
SMILESCCN(C(=O)c1nn(C)cc1N)c1ccc(F)cc1
InChIInChI=1S/C13H15FN4O/c1-3-18(10-6-4-9(14)5-7-10)13(19)12-11(15)8-17(2)16-12/h4-8H,3,15H2,1-2H3
InChIKeyOCBAFZHHKZASKV-UHFFFAOYSA-N
MW262.29 g/mol
LogP1.81
Rot. Bonds3

About 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide

4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide (PubChem CID 65354287) has the molecular formula C13H15FN4O and a molecular weight of 262.29 g/mol. Its IUPAC name is 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide
PubChem CID65354287
Molecular FormulaC13H15FN4O
Molecular Weight262.29 g/mol
Exact Mass262.12
IUPAC Name4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide
SMILESCCN(C(=O)c1nn(C)cc1N)c1ccc(F)cc1
InChIInChI=1S/C13H15FN4O/c1-3-18(10-6-4-9(14)5-7-10)13(19)12-11(15)8-17(2)16-12/h4-8H,3,15H2,1-2H3
InChIKeyOCBAFZHHKZASKV-UHFFFAOYSA-N
XLogP1.81
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.29
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-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

4-amino-N-butyl-1-methyl-N-phenylpyrazole-3-carboxamide
CID 65355446
4-amino-N,N-diethyl-1-methylpyrazole-3-carboxamide
CID 65355148
4-amino-N-ethyl-1-(2-fluoroethyl)-N-phenylpyrazole-3-carboxamide
CID 132586605
3-N,4-N-diethyl-1-methyl-3-N,4-N-diphenylpyrazole-3,4-dicarboxamide
CID 29097744
3-amino-N-ethyl-N-(4-fluorophenyl)pyridine-4-carboxamide
CID 105069018
3-amino-N-ethyl-2,6-difluoro-N-(4-fluorophenyl)benzamide
CID 79758297
3,6-dichloro-N-ethyl-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 60659860
2-amino-N-ethyl-N-(4-fluorophenyl)-6-methoxybenzamide
CID 81393771
4-amino-N-ethyl-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 62160198
4-amino-3,5-dichloro-N-ethyl-N-(4-fluorophenyl)benzamide
CID 82811257
4-amino-N-[1-(dimethylamino)propan-2-yl]-N-ethyl-1-methylpyrazole-3-carboxamide
CID 103187371
N-(3-aminopropyl)-N-(4-fluorophenyl)-1,3-dimethylpyrazole-4-carboxamide
CID 102801026

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide (CID 65354287) is 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide is CCN(C(=O)c1nn(C)cc1N)c1ccc(F)cc1.
What is the InChIKey of 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide?
The InChIKey is OCBAFZHHKZASKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4O/c1-3-18(10-6-4-9(14)5-7-10)13(19)12-11(15)8-17(2)16-12/h4-8H,3,15H2,1-2H3.
What are the key properties of 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide?
4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide has a molecular weight of 262.29 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-ethyl-N-(4-fluorophenyl)-1-methylpyrazole-3-carboxamide is sourced from PubChem (CID 65354287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).