6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide

C13H10ClFN2O2 — CID 686763

IUPAC6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)nc(Oc2ccc(F)cc2)c1C(N)=O
InChIInChI=1S/C13H10ClFN2O2/c1-7-6-10(14)17-13(11(7)12(16)18)19-9-4-2-8(15)3-5-9/h2-6H,1H3,(H2,16,18)
InChIKeyAEGBXNHNVKZFRX-UHFFFAOYSA-N
MW280.69 g/mol
LogP3.07
Rot. Bonds3

About 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide

6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide (PubChem CID 686763) has the molecular formula C13H10ClFN2O2 and a molecular weight of 280.69 g/mol. Its IUPAC name is 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide
PubChem CID686763
Molecular FormulaC13H10ClFN2O2
Molecular Weight280.69 g/mol
Exact Mass280.04
IUPAC Name6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide
SMILESCc1cc(Cl)nc(Oc2ccc(F)cc2)c1C(N)=O
InChIInChI=1S/C13H10ClFN2O2/c1-7-6-10(14)17-13(11(7)12(16)18)19-9-4-2-8(15)3-5-9/h2-6H,1H3,(H2,16,18)
InChIKeyAEGBXNHNVKZFRX-UHFFFAOYSA-N
XLogP3.07
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.69
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-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

2-(4-Chlorophenoxy)nicotinamide
CID 2774902
2-(2,4-Dichlorophenoxy)-3-pyridinecarboxamide
CID 2727464
2-(3-Chlorophenoxy)nicotinamide
CID 1211466
N-(3-chloro-4-fluorophenyl)-2-ethoxypyridine-3-carboxamide
CID 2477363
N-[(2-chlorophenyl)methyl]-2-phenoxypyridine-3-carboxamide
CID 26644345
2-(4-chlorophenoxy)-N-(2,4-difluorophenyl)-4-(trifluoromethyl)nicotinamide
CID 2727242
N-[(2-chlorophenyl)methyl]-2-(2-fluorophenoxy)pyridine-3-carboxamide
CID 44397450
5-chloro-N-ethyl-2-(4-fluorophenoxy)-4,6-dimethyl-N-phenylpyridine-3-carboxamide
CID 3453004
5-chloro-2-(4-fluorophenoxy)-4,6-dimethyl-N-(prop-2-en-1-yl)pyridine-3-carboxamide
CID 4281155
5-Chloro-2-(4-fluorophenoxy)-4,6-dimethylpyridine-3-carboxamide
CID 728735
5-Chloro-2-(4-fluorophenoxy)-4,6-dimethylpyridine-3-carboxylic acid
CID 778151
2,4,6-trichloro-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 579068

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide?
The IUPAC name of 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide (CID 686763) is 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide?
The canonical SMILES for 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide is Cc1cc(Cl)nc(Oc2ccc(F)cc2)c1C(N)=O.
What is the InChIKey of 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide?
The InChIKey is AEGBXNHNVKZFRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClFN2O2/c1-7-6-10(14)17-13(11(7)12(16)18)19-9-4-2-8(15)3-5-9/h2-6H,1H3,(H2,16,18).
What are the key properties of 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide?
6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide has a molecular weight of 280.69 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(4-fluorophenoxy)-4-methylpyridine-3-carboxamide is sourced from PubChem (CID 686763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).