N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide

C11H6ClF2N3O — CID 177336273

IUPACN-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide
SMILESO=C(Nc1cnc(Cl)c(F)c1)c1cccnc1F
InChIInChI=1S/C11H6ClF2N3O/c12-9-8(13)4-6(5-16-9)17-11(18)7-2-1-3-15-10(7)14/h1-5H,(H,17,18)
InChIKeyDAFHGLRPLPINBF-UHFFFAOYSA-N
MW269.64 g/mol
LogP2.66
Rot. Bonds2

About N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide

N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide (PubChem CID 177336273) has the molecular formula C11H6ClF2N3O and a molecular weight of 269.64 g/mol. Its IUPAC name is N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide.

Molecular Properties

Compound NameN-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide
PubChem CID177336273
Molecular FormulaC11H6ClF2N3O
Molecular Weight269.64 g/mol
Exact Mass269.02
IUPAC NameN-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide
SMILESO=C(Nc1cnc(Cl)c(F)c1)c1cccnc1F
InChIInChI=1S/C11H6ClF2N3O/c12-9-8(13)4-6(5-16-9)17-11(18)7-2-1-3-15-10(7)14/h1-5H,(H,17,18)
InChIKeyDAFHGLRPLPINBF-UHFFFAOYSA-N
XLogP2.66
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.64
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(6-chloro-5-methyl-3-pyridinyl)-2-fluoropyridine-3-carboxamide
CID 107363154
2-fluoro-N-(6-fluoro-3-pyridinyl)pyridine-3-carboxamide
CID 107358891
N-(4-chloro-2-fluorophenyl)-2-fluoropyridine-3-carboxamide
CID 107362716
N-(5-bromo-6-chloro-3-pyridinyl)-2-chloropyridine-3-carboxamide
CID 103816473
N-(4-chloro-2-pyridinyl)-2-fluoropyridine-3-carboxamide
CID 107358819
N-(3-acetamido-4-fluorophenyl)-2-fluoropyridine-3-carboxamide
CID 107358587
N-(4-bromo-3-methylphenyl)-2-fluoropyridine-3-carboxamide
CID 107358538
N-(6-chloro-5-methyl-3-pyridinyl)-3-fluoropyridine-4-carboxamide
CID 103745275
2-chloro-N-(4-ethoxy-3-fluorophenyl)pyridine-3-carboxamide
CID 115588705
2-chloro-N-(5-methyl-3-pyridinyl)pyridine-3-carboxamide
CID 103738978
N-(5-bromo-6-chloro-3-pyridinyl)-2,3,4-trifluorobenzamide
CID 104624666
5-bromo-N-(5-bromo-6-chloro-3-pyridinyl)-2-fluorobenzamide
CID 113267905

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide?
The IUPAC name of N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide (CID 177336273) is N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide.
What is the SMILES notation for N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide?
The canonical SMILES for N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide is O=C(Nc1cnc(Cl)c(F)c1)c1cccnc1F.
What is the InChIKey of N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide?
The InChIKey is DAFHGLRPLPINBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF2N3O/c12-9-8(13)4-6(5-16-9)17-11(18)7-2-1-3-15-10(7)14/h1-5H,(H,17,18).
What are the key properties of N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide?
N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide has a molecular weight of 269.64 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-5-fluoro-3-pyridinyl)-2-fluoropyridine-3-carboxamide is sourced from PubChem (CID 177336273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).