2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide

C15H8Cl2F2N4O — CID 139006784

IUPAC2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide
SMILESO=C(Nc1ccnn1-c1cccc(F)c1)c1cc(F)c(Cl)nc1Cl
InChIInChI=1S/C15H8Cl2F2N4O/c16-13-10(7-11(19)14(17)22-13)15(24)21-12-4-5-20-23(12)9-3-1-2-8(18)6-9/h1-7H,(H,21,24)
InChIKeyYXOYWVBUYKTIGK-UHFFFAOYSA-N
MW369.16 g/mol
LogP4.10
Rot. Bonds3

About 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide

2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide (PubChem CID 139006784) has the molecular formula C15H8Cl2F2N4O and a molecular weight of 369.16 g/mol. Its IUPAC name is 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide
PubChem CID139006784
Molecular FormulaC15H8Cl2F2N4O
Molecular Weight369.16 g/mol
Exact Mass368.00
IUPAC Name2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide
SMILESO=C(Nc1ccnn1-c1cccc(F)c1)c1cc(F)c(Cl)nc1Cl
InChIInChI=1S/C15H8Cl2F2N4O/c16-13-10(7-11(19)14(17)22-13)15(24)21-12-4-5-20-23(12)9-3-1-2-8(18)6-9/h1-7H,(H,21,24)
InChIKeyYXOYWVBUYKTIGK-UHFFFAOYSA-N
XLogP4.10
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.16
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-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

N-[2-(3-fluorophenyl)pyrazol-3-yl]cyclopropanecarboxamide
CID 166219983
N-[2-(3-fluorophenyl)pyrazol-3-yl]-3-(tetrazol-1-yl)benzamide
CID 122138944
2-amino-N-(2-phenylpyrazol-3-yl)benzamide
CID 14638390
(2S)-N-[2-(3-fluorophenyl)pyrazol-3-yl]-2-[[(2R)-oxan-2-yl]methoxy]propanamide
CID 124617036
2-chloro-N-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-4,5-difluorobenzamide
CID 55377836
5-chloro-N-[2-(3-chlorophenyl)-5-methylpyrazol-3-yl]-2-fluorobenzamide
CID 55481154
N-[3-tert-butyl-1-(3-fluorophenyl)pyrazol-5-yl]-2,4-difluorobenzamide
CID 46087955
3-chloro-4-fluoro-N-[1-(3-fluorophenyl)-3-phenylpyrazol-5-yl]benzamide
CID 46088012
1-(3-chlorophenyl)-N-(2,4-difluorophenyl)-5-propan-2-ylpyrazole-4-carboxamide
CID 55576681
3-fluoro-N-(2-methylpyrazol-3-yl)benzamide
CID 110472464
N-(2-phenylpyrazol-3-yl)acetamide
CID 12678799
1-(3-fluorophenyl)-N-(4-fluorophenyl)-5-pyrrol-1-ylpyrazole-4-carboxamide
CID 20936933

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide?
The IUPAC name of 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide (CID 139006784) is 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide.
What is the SMILES notation for 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide?
The canonical SMILES for 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide is O=C(Nc1ccnn1-c1cccc(F)c1)c1cc(F)c(Cl)nc1Cl.
What is the InChIKey of 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide?
The InChIKey is YXOYWVBUYKTIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8Cl2F2N4O/c16-13-10(7-11(19)14(17)22-13)15(24)21-12-4-5-20-23(12)9-3-1-2-8(18)6-9/h1-7H,(H,21,24).
What are the key properties of 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide?
2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide has a molecular weight of 369.16 g/mol, XLogP of 4.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-5-fluoro-N-[2-(3-fluorophenyl)pyrazol-3-yl]pyridine-3-carboxamide is sourced from PubChem (CID 139006784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).