3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide

C23H25FN4O — CID 174913760

IUPAC3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide
SMILESCCCCc1c(C(N)=O)cc(-c2ccc(F)cc2)nc1-c1ccnn1CC1CC1
InChIInChI=1S/C23H25FN4O/c1-2-3-4-18-19(23(25)29)13-20(16-7-9-17(24)10-8-16)27-22(18)21-11-12-26-28(21)14-15-5-6-15/h7-13,15H,2-6,14H2,1H3,(H2,25,29)
InChIKeyLZWYGSQXIHYKDT-UHFFFAOYSA-N
MW392.48 g/mol
LogP4.60
Rot. Bonds8

About 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide

3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide (PubChem CID 174913760) has the molecular formula C23H25FN4O and a molecular weight of 392.48 g/mol. Its IUPAC name is 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide
PubChem CID174913760
Molecular FormulaC23H25FN4O
Molecular Weight392.48 g/mol
Exact Mass392.20
IUPAC Name3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide
SMILESCCCCc1c(C(N)=O)cc(-c2ccc(F)cc2)nc1-c1ccnn1CC1CC1
InChIInChI=1S/C23H25FN4O/c1-2-3-4-18-19(23(25)29)13-20(16-7-9-17(24)10-8-16)27-22(18)21-11-12-26-28(21)14-15-5-6-15/h7-13,15H,2-6,14H2,1H3,(H2,25,29)
InChIKeyLZWYGSQXIHYKDT-UHFFFAOYSA-N
XLogP4.60
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-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

2-tert-butyl-3-[2-(cyclopropylmethyl)pyrazol-3-yl]-5-(4-fluorophenyl)benzamide
CID 174932650
N-tert-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-[4-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 130298804
2-(oxan-4-ylmethyl)pyrazole-3-carboxamide
CID 90104813
2-(2-ethylpyrazol-3-yl)-6-methylpyridine-3-carboxamide
CID 122569455
1-(cyclopropylmethyl)-5-(4-fluorophenyl)-4-methylpyrazol-3-amine
CID 134439969
5-butyl-1-cyclopropyl-4-(4-fluorophenyl)-2-methylpyrrole-3-carboxamide
CID 3791738
2-(cyclopropylmethyl)-5-methylpyrazole-3-carboxamide
CID 161043600
5-(cyclopentylmethyl)-2-(4-fluorophenyl)pyrazolo[1,5-d][1,2,4]triazin-4-one
CID 172893757
1-(cyclopropylmethyl)-5-(4-fluorophenyl)triazole-4-carboxylic acid
CID 102644330
N-butyl-1-(cyclohexylmethyl)-5-(4-fluorophenyl)-2-methylpyrrole-3-carboxamide
CID 10022081
6-butyl-2-(4-methylphenyl)quinoline-4-carboxylic acid
CID 3996403
ethyl 1-[9-amino-1-(cyclopropylmethyl)-3-(4-fluorophenyl)-10H-pyrazolo[5,4-f][1,5]diazonin-7-yl]-3,5-dimethylpyrazole-4-carboxylate
CID 137305516

Frequently Asked Questions

What is the IUPAC name of 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide?
The IUPAC name of 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide (CID 174913760) is 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide is CCCCc1c(C(N)=O)cc(-c2ccc(F)cc2)nc1-c1ccnn1CC1CC1.
What is the InChIKey of 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide?
The InChIKey is LZWYGSQXIHYKDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN4O/c1-2-3-4-18-19(23(25)29)13-20(16-7-9-17(24)10-8-16)27-22(18)21-11-12-26-28(21)14-15-5-6-15/h7-13,15H,2-6,14H2,1H3,(H2,25,29).
What are the key properties of 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide?
3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide has a molecular weight of 392.48 g/mol, XLogP of 4.60, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butyl-2-[2-(cyclopropylmethyl)pyrazol-3-yl]-6-(4-fluorophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 174913760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).