N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide

C13H11IN2O2 — CID 103610749

IUPACN-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2ccc(I)cc2)cc1=O
InChIInChI=1S/C13H11IN2O2/c1-16-7-6-9(8-12(16)17)13(18)15-11-4-2-10(14)3-5-11/h2-8H,1H3,(H,15,18)
InChIKeyYHKLBKBQWMNSQM-UHFFFAOYSA-N
MW354.15 g/mol
LogP2.24
Rot. Bonds2

About N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide

N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 103610749) has the molecular formula C13H11IN2O2 and a molecular weight of 354.15 g/mol. Its IUPAC name is N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID103610749
Molecular FormulaC13H11IN2O2
Molecular Weight354.15 g/mol
Exact Mass353.99
IUPAC NameN-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)Nc2ccc(I)cc2)cc1=O
InChIInChI=1S/C13H11IN2O2/c1-16-7-6-9(8-12(16)17)13(18)15-11-4-2-10(14)3-5-11/h2-8H,1H3,(H,15,18)
InChIKeyYHKLBKBQWMNSQM-UHFFFAOYSA-N
XLogP2.24
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.15
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(2-amino-2-oxoethyl)phenyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 31861747
N-(4-ethoxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103610716
N-(3-hydroxy-4-methylphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103772619
N-(3,4-dimethoxyphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103610764
1-N,3-N,5-N-tris(4-iodophenyl)benzene-1,3,5-tricarboxamide
CID 102258249
4-iodo-N-[4-[(4-iodobenzoyl)amino]phenyl]benzamide
CID 4105689
1-methyl-N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-oxopyridine-4-carboxamide
CID 39991070
N-(5-amino-2-methylphenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 106813423
N-(2-bromo-4-chlorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103774923
N-(5-bromo-2,4-difluorophenyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 99824990
N-(9-ethylcarbazol-3-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 35740949
N-[3-[(dimethylamino)methyl]phenyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 86932107

Frequently Asked Questions

What is the IUPAC name of N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide (CID 103610749) is N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)Nc2ccc(I)cc2)cc1=O.
What is the InChIKey of N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is YHKLBKBQWMNSQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11IN2O2/c1-16-7-6-9(8-12(16)17)13(18)15-11-4-2-10(14)3-5-11/h2-8H,1H3,(H,15,18).
What are the key properties of N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide?
N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 354.15 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-iodophenyl)-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 103610749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).