2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide

C15H11ClFN5O — CID 166234236

IUPAC2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)cc(Cl)n1
InChIInChI=1S/C15H11ClFN5O/c16-13-5-9(6-14(18)21-13)15(23)20-10-7-19-22(8-10)12-4-2-1-3-11(12)17/h1-8H,(H2,18,21)(H,20,23)
InChIKeyUCLMKPMLZFSKAZ-UHFFFAOYSA-N
MW331.74 g/mol
LogP2.89
Rot. Bonds3

About 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide

2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide (PubChem CID 166234236) has the molecular formula C15H11ClFN5O and a molecular weight of 331.74 g/mol. Its IUPAC name is 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide
PubChem CID166234236
Molecular FormulaC15H11ClFN5O
Molecular Weight331.74 g/mol
Exact Mass331.06
IUPAC Name2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)cc(Cl)n1
InChIInChI=1S/C15H11ClFN5O/c16-13-5-9(6-14(18)21-13)15(23)20-10-7-19-22(8-10)12-4-2-1-3-11(12)17/h1-8H,(H2,18,21)(H,20,23)
InChIKeyUCLMKPMLZFSKAZ-UHFFFAOYSA-N
XLogP2.89
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.74
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-fluoro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-2-carboxamide
CID 99821177
N-[1-(2-fluorophenyl)pyrazol-4-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 75378606
1-ethyl-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyrazole-4-carboxamide
CID 71921815
N-(3,5-difluorophenyl)-1-(2-fluorophenyl)pyrazole-4-carboxamide
CID 94828526
(2S)-2-amino-N-[1-(2-fluorophenyl)pyrazol-4-yl]-3-methylbutanamide
CID 119329634
2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide
CID 62154226
2-amino-6-chloro-N-(1,2-thiazol-4-yl)pyridine-4-carboxamide
CID 154842220
2-amino-6-chloro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 62156439
2-amino-6-chloro-N-(2-iodophenyl)pyridine-4-carboxamide
CID 62154227
N-[1-(2-fluorophenyl)pyrazol-4-yl]cyclohexanecarboxamide
CID 141275060
2-amino-6-chloro-N-(2-fluoro-4-methylphenyl)pyridine-4-carboxamide
CID 62151947
N-[1-(2-fluorophenyl)pyrazol-4-yl]-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 99626147

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide (CID 166234236) is 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide is Nc1cc(C(=O)Nc2cnn(-c3ccccc3F)c2)cc(Cl)n1.
What is the InChIKey of 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide?
The InChIKey is UCLMKPMLZFSKAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN5O/c16-13-5-9(6-14(18)21-13)15(23)20-10-7-19-22(8-10)12-4-2-1-3-11(12)17/h1-8H,(H2,18,21)(H,20,23).
What are the key properties of 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide?
2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide has a molecular weight of 331.74 g/mol, XLogP of 2.89, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-[1-(2-fluorophenyl)pyrazol-4-yl]pyridine-4-carboxamide is sourced from PubChem (CID 166234236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).