5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide

C12H7Cl3N2O2 — CID 53324704

IUPAC5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C12H7Cl3N2O2/c13-7-1-2-10(8(14)4-7)17-11(18)6-3-9(15)12(19)16-5-6/h1-5H,(H,16,19)(H,17,18)
InChIKeyPGAAWBFRYWDGPK-UHFFFAOYSA-N
MW317.56 g/mol
LogP3.59
Rot. Bonds2

About 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide

5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 53324704) has the molecular formula C12H7Cl3N2O2 and a molecular weight of 317.56 g/mol. Its IUPAC name is 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID53324704
Molecular FormulaC12H7Cl3N2O2
Molecular Weight317.56 g/mol
Exact Mass315.96
IUPAC Name5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Cl)c1c[nH]c(=O)c(Cl)c1
InChIInChI=1S/C12H7Cl3N2O2/c13-7-1-2-10(8(14)4-7)17-11(18)6-3-9(15)12(19)16-5-6/h1-5H,(H,16,19)(H,17,18)
InChIKeyPGAAWBFRYWDGPK-UHFFFAOYSA-N
XLogP3.59
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.56
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide (CID 53324704) is 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide is O=C(Nc1ccc(Cl)cc1Cl)c1c[nH]c(=O)c(Cl)c1.
What is the InChIKey of 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is PGAAWBFRYWDGPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl3N2O2/c13-7-1-2-10(8(14)4-7)17-11(18)6-3-9(15)12(19)16-5-6/h1-5H,(H,16,19)(H,17,18).
What are the key properties of 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide?
5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 317.56 g/mol, XLogP of 3.59, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,4-dichlorophenyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 53324704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).