N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide

C13H10Cl2N2O3 — CID 103891192

IUPACN-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2O)cc1=O
InChIInChI=1S/C13H10Cl2N2O3/c1-17-3-2-7(4-11(17)18)13(20)16-10-6-8(14)5-9(15)12(10)19/h2-6,19H,1H3,(H,16,20)
InChIKeyDOIJGHLMQXHOPO-UHFFFAOYSA-N
MW313.14 g/mol
LogP2.65
Rot. Bonds2

About N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide

N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 103891192) has the molecular formula C13H10Cl2N2O3 and a molecular weight of 313.14 g/mol. Its IUPAC name is N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID103891192
Molecular FormulaC13H10Cl2N2O3
Molecular Weight313.14 g/mol
Exact Mass312.01
IUPAC NameN-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2O)cc1=O
InChIInChI=1S/C13H10Cl2N2O3/c1-17-3-2-7(4-11(17)18)13(20)16-10-6-8(14)5-9(15)12(10)19/h2-6,19H,1H3,(H,16,20)
InChIKeyDOIJGHLMQXHOPO-UHFFFAOYSA-N
XLogP2.65
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.14
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

N-(2-bromo-4-chlorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103774923
1-methyl-2-oxo-N'-(2,4,6-trichlorophenyl)pyridine-4-carbohydrazide
CID 35556076
4-chloro-N-(3,5-dichloro-2-hydroxyphenyl)benzamide
CID 107675874
2-chloro-6-[(1-methyl-2-oxopyridine-4-carbonyl)amino]benzoic acid
CID 63722587
N-(3,5-dichloro-2-hydroxyphenyl)-4-hydroxy-3-methylbenzamide
CID 103958263
N-(2-chloro-4-cyanophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103799723
N-(3,5-dichloro-2-hydroxyphenyl)-3,5-dimethylbenzamide
CID 107675698
N-(3,5-dichloro-2-hydroxyphenyl)-3-methylimidazole-4-carboxamide
CID 107675810
N-(5-amino-2-fluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103793620
N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103610749
N-(5-amino-2-methylphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 106813423
N-(5-bromo-2,4-difluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 99824990

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide (CID 103891192) is N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2O)cc1=O.
What is the InChIKey of N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is DOIJGHLMQXHOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2O3/c1-17-3-2-7(4-11(17)18)13(20)16-10-6-8(14)5-9(15)12(10)19/h2-6,19H,1H3,(H,16,20).
What are the key properties of N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide?
N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 313.14 g/mol, XLogP of 2.65, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-2-hydroxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103891192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).