6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide

C8H7ClF2N2O2 — CID 119005525

IUPAC6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide
SMILESCOc1cc(C(F)F)c(C(N)=O)nc1Cl
InChIInChI=1S/C8H7ClF2N2O2/c1-15-4-2-3(7(10)11)5(8(12)14)13-6(4)9/h2,7H,1H3,(H2,12,14)
InChIKeyAANCWGLERKKZBH-UHFFFAOYSA-N
MW236.60 g/mol
LogP1.78
Rot. Bonds3

About 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide

6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide (PubChem CID 119005525) has the molecular formula C8H7ClF2N2O2 and a molecular weight of 236.60 g/mol. Its IUPAC name is 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide
PubChem CID119005525
Molecular FormulaC8H7ClF2N2O2
Molecular Weight236.60 g/mol
Exact Mass236.02
IUPAC Name6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide
SMILESCOc1cc(C(F)F)c(C(N)=O)nc1Cl
InChIInChI=1S/C8H7ClF2N2O2/c1-15-4-2-3(7(10)11)5(8(12)14)13-6(4)9/h2,7H,1H3,(H2,12,14)
InChIKeyAANCWGLERKKZBH-UHFFFAOYSA-N
XLogP1.78
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.60
LogP ≤ 51.78
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

3-(difluoromethyl)-5-methoxy-6-methylpyridine-2-carboxamide
CID 133098966
6-bromo-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide
CID 118992492
6-chloro-3-(difluoromethyl)-5-methoxypyridin-2-amine
CID 130102532
5-chloro-3-(difluoromethyl)-6-fluoropyridine-2-carboxamide
CID 130072214
6-bromo-3-(difluoromethyl)-5-methoxypyridine-2-carbonyl chloride
CID 134670863
6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carbonitrile
CID 119010171
6-bromo-5-(difluoromethyl)-3-methoxypyridine-2-carbonyl chloride
CID 134675810
5-(difluoromethyl)-3-methoxy-6-methylpyridine-2-carbonyl chloride
CID 133099566
4-(difluoromethyl)-6-methoxy-3-methylpyridine-2-carboxamide
CID 118840796
4-(difluoromethyl)-3-hydroxy-6-methoxypyridine-2-carboxamide
CID 118829275
6-(chloromethyl)-3-(difluoromethyl)-5-methoxypyridine-2-carboxylic acid
CID 118804374
2-chloro-5-(difluoromethyl)-6-methylpyridine-3-carboxamide
CID 119018698

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide?
The IUPAC name of 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide (CID 119005525) is 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide?
The canonical SMILES for 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide is COc1cc(C(F)F)c(C(N)=O)nc1Cl.
What is the InChIKey of 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide?
The InChIKey is AANCWGLERKKZBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClF2N2O2/c1-15-4-2-3(7(10)11)5(8(12)14)13-6(4)9/h2,7H,1H3,(H2,12,14).
What are the key properties of 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide?
6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide has a molecular weight of 236.60 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(difluoromethyl)-5-methoxypyridine-2-carboxamide is sourced from PubChem (CID 119005525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).