6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide

C12H9ClFN3O — CID 62155431

IUPAC6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide
SMILESNc1ccc(C(=O)Nc2ccc(F)cc2Cl)cn1
InChIInChI=1S/C12H9ClFN3O/c13-9-5-8(14)2-3-10(9)17-12(18)7-1-4-11(15)16-6-7/h1-6H,(H2,15,16)(H,17,18)
InChIKeyLSGUWAKVPXHEPL-UHFFFAOYSA-N
MW265.68 g/mol
LogP2.71
Rot. Bonds2

About 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide

6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide (PubChem CID 62155431) has the molecular formula C12H9ClFN3O and a molecular weight of 265.68 g/mol. Its IUPAC name is 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide
PubChem CID62155431
Molecular FormulaC12H9ClFN3O
Molecular Weight265.68 g/mol
Exact Mass265.04
IUPAC Name6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide
SMILESNc1ccc(C(=O)Nc2ccc(F)cc2Cl)cn1
InChIInChI=1S/C12H9ClFN3O/c13-9-5-8(14)2-3-10(9)17-12(18)7-1-4-11(15)16-6-7/h1-6H,(H2,15,16)(H,17,18)
InChIKeyLSGUWAKVPXHEPL-UHFFFAOYSA-N
XLogP2.71
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.68
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-(2,5-difluorophenyl)pyridine-3-carboxamide
CID 62152342
6-amino-N-(2-chloro-4-cyanophenyl)pyridine-3-carboxamide
CID 107810194
5-chloro-N-(2-chloro-4-fluorophenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62166998
N-(2-chloro-4-fluorophenyl)-3,4-difluorobenzamide
CID 30431388
6-amino-N-(3,5-difluorophenyl)pyridine-3-carboxamide
CID 62154384
N-(2-chloro-4-fluorophenyl)-6-(N-methylanilino)pyridine-3-carboxamide
CID 112830348
6-amino-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 62155230
6-amino-N-(4-bromo-2,3-dichlorophenyl)pyridine-3-carboxamide
CID 107793435
6-amino-N-(2-chloro-4-fluorophenyl)pyridine-2-carboxamide
CID 62239457
5-chloro-N-(2-chloro-4-fluorophenyl)pyrazine-2-carboxamide
CID 107371772
6-amino-N-(4-bromo-2-methylphenyl)pyridine-3-carboxamide
CID 62151975
6-amino-5-chloro-N-(4-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 62156604

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide (CID 62155431) is 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide is Nc1ccc(C(=O)Nc2ccc(F)cc2Cl)cn1.
What is the InChIKey of 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide?
The InChIKey is LSGUWAKVPXHEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClFN3O/c13-9-5-8(14)2-3-10(9)17-12(18)7-1-4-11(15)16-6-7/h1-6H,(H2,15,16)(H,17,18).
What are the key properties of 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide?
6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide has a molecular weight of 265.68 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-chloro-4-fluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 62155431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).