N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide

C13H9ClF2N2O2 — CID 2579010

IUPACN-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(OC(F)F)c(Cl)c1)c1ccccn1
InChIInChI=1S/C13H9ClF2N2O2/c14-9-7-8(4-5-11(9)20-13(15)16)18-12(19)10-3-1-2-6-17-10/h1-7,13H,(H,18,19)
InChIKeySCLTWTGGSMDTAB-UHFFFAOYSA-N
MW298.68 g/mol
LogP3.59
Rot. Bonds4

About N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide

N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide (PubChem CID 2579010) has the molecular formula C13H9ClF2N2O2 and a molecular weight of 298.68 g/mol. Its IUPAC name is N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide
PubChem CID2579010
Molecular FormulaC13H9ClF2N2O2
Molecular Weight298.68 g/mol
Exact Mass298.03
IUPAC NameN-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(OC(F)F)c(Cl)c1)c1ccccn1
InChIInChI=1S/C13H9ClF2N2O2/c14-9-7-8(4-5-11(9)20-13(15)16)18-12(19)10-3-1-2-6-17-10/h1-7,13H,(H,18,19)
InChIKeySCLTWTGGSMDTAB-UHFFFAOYSA-N
XLogP3.59
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.68
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-3-carboxamide
CID 26901535
N-[3-chloro-4-(difluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19414567
N-[3-chloro-4-(difluoromethoxy)phenyl]-2,2-difluoroacetamide
CID 113218222
N-[3-chloro-4-(difluoromethoxy)phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 26901420
N-[3-chloro-4-(difluoromethoxy)phenyl]-3-phenylimidazole-4-carboxamide
CID 29110977
N-[4-chloro-3-(triiodomethoxy)phenyl]pyridine-2-carboxamide
CID 166998512
2-chloro-N-[3-chloro-4-(difluoromethoxy)phenyl]acetamide
CID 4885557
3-(carbamoylamino)-N-[3-chloro-4-(difluoromethoxy)phenyl]benzamide
CID 26247982
N-[3-chloro-4-(difluoromethoxy)phenyl]-3-methyl-4-oxophthalazine-1-carboxamide
CID 7942994
1-[3-chloro-4-(difluoromethoxy)phenyl]-3-(3-chlorophenyl)urea
CID 8002775
N-(3,5-dichloro-4-hydroxyphenyl)pyridine-2-carboxamide
CID 82884387
N-[3-chloro-4-(difluoromethoxy)phenyl]-4-(dimethylamino)benzamide
CID 24576004

Frequently Asked Questions

What is the IUPAC name of N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide (CID 2579010) is N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide is O=C(Nc1ccc(OC(F)F)c(Cl)c1)c1ccccn1.
What is the InChIKey of N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide?
The InChIKey is SCLTWTGGSMDTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2N2O2/c14-9-7-8(4-5-11(9)20-13(15)16)18-12(19)10-3-1-2-6-17-10/h1-7,13H,(H,18,19).
What are the key properties of N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide?
N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide has a molecular weight of 298.68 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-chloro-4-(difluoromethoxy)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 2579010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).