N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide

C16H11Cl2N3O — CID 110863992

IUPACN-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide
SMILESCc1nc2ccncc2cc1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C16H11Cl2N3O/c1-9-12(6-10-8-19-5-4-15(10)20-9)16(22)21-11-2-3-13(17)14(18)7-11/h2-8H,1H3,(H,21,22)
InChIKeyVMJFONAADZSRLU-UHFFFAOYSA-N
MW332.19 g/mol
LogP4.50
Rot. Bonds2

About N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide

N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide (PubChem CID 110863992) has the molecular formula C16H11Cl2N3O and a molecular weight of 332.19 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide
PubChem CID110863992
Molecular FormulaC16H11Cl2N3O
Molecular Weight332.19 g/mol
Exact Mass331.03
IUPAC NameN-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide
SMILESCc1nc2ccncc2cc1C(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C16H11Cl2N3O/c1-9-12(6-10-8-19-5-4-15(10)20-9)16(22)21-11-2-3-13(17)14(18)7-11/h2-8H,1H3,(H,21,22)
InChIKeyVMJFONAADZSRLU-UHFFFAOYSA-N
XLogP4.50
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.19
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-methylphenyl)-2-methyl-1,6-naphthyridine-3-carboxamide
CID 110859285
N-(3-acetamidophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide
CID 110861356
2-methyl-N-(2-methylphenyl)-1,6-naphthyridine-3-carboxamide
CID 110856628
N-(3,4-dichlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81442671
N-(3,4-dichlorophenyl)-4-methylpyrimidine-5-carboxamide
CID 110863958
N-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-methyl-1,6-naphthyridine-3-carboxamide
CID 11234562
N-[3-chloro-4-(cyclopropylcarbamoyl)phenyl]-2,6-dimethylquinoline-3-carboxamide
CID 55805245
5-amino-N-(3,4-dichlorophenyl)-2-methylbenzamide
CID 61291913
N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]-2-methylquinoline-3-carboxamide
CID 87032124
N-(3-chloro-4-methylphenyl)-4-(methylamino)pyridine-3-carboxamide
CID 81233976
N-(3-chloro-4-fluorophenyl)-3-methylpyridine-4-carboxamide
CID 110859368
4-chloro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 107701234

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide (CID 110863992) is N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide is Cc1nc2ccncc2cc1C(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide?
The InChIKey is VMJFONAADZSRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl2N3O/c1-9-12(6-10-8-19-5-4-15(10)20-9)16(22)21-11-2-3-13(17)14(18)7-11/h2-8H,1H3,(H,21,22).
What are the key properties of N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide?
N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide has a molecular weight of 332.19 g/mol, XLogP of 4.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-methyl-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 110863992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).