N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide

C22H15Cl2N3O2 — CID 59833886

IUPACN-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide
SMILESCn1c(=O)c(-c2c(Cl)ccc(NC(=O)c3ccccc3)c2Cl)cc2cnccc21
InChIInChI=1S/C22H15Cl2N3O2/c1-27-18-9-10-25-12-14(18)11-15(22(27)29)19-16(23)7-8-17(20(19)24)26-21(28)13-5-3-2-4-6-13/h2-12H,1H3,(H,26,28)
InChIKeySYTXERXNZCFTBD-UHFFFAOYSA-N
MW424.29 g/mol
LogP5.16
Rot. Bonds3

About N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide

N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide (PubChem CID 59833886) has the molecular formula C22H15Cl2N3O2 and a molecular weight of 424.29 g/mol. Its IUPAC name is N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide
PubChem CID59833886
Molecular FormulaC22H15Cl2N3O2
Molecular Weight424.29 g/mol
Exact Mass423.05
IUPAC NameN-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide
SMILESCn1c(=O)c(-c2c(Cl)ccc(NC(=O)c3ccccc3)c2Cl)cc2cnccc21
InChIInChI=1S/C22H15Cl2N3O2/c1-27-18-9-10-25-12-14(18)11-15(22(27)29)19-16(23)7-8-17(20(19)24)26-21(28)13-5-3-2-4-6-13/h2-12H,1H3,(H,26,28)
InChIKeySYTXERXNZCFTBD-UHFFFAOYSA-N
XLogP5.16
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.29
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]-3-methylbenzamide
CID 59833938
3-bromo-N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide
CID 59833874
N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]-4-(methylamino)benzamide
CID 143032077
N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]-3-methylbutanamide
CID 59833815
N-[2,4-dichloro-3-(1-ethyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]-3-(trifluoromethyl)benzamide
CID 59833883
N-[2,4-dichloro-3-[8-methyl-2-(3-methylsulfanylanilino)-7-oxopyrido[2,3-d]pyrimidin-6-yl]phenyl]-3-(trifluoromethyl)benzamide
CID 59833850
N-[4-(aminomethyl)-3-(7-chloro-1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide
CID 174591274
N-(6-benzamido-1,5-dichloro-9,10-dioxoanthracen-2-yl)benzamide
CID 10962330
N-(6-methoxy-1-methyl-2-oxoquinolin-3-yl)benzamide
CID 101228890
N-[4-(dimethylamino)-3-pyridinyl]benzamide
CID 63319086
4-(2-chlorophenyl)-1-methyl-2-oxo-1,7-naphthyridine-3-carboxylic acid
CID 22106030
1,3-dimethyl-2-oxo-N-quinolin-8-ylbenzimidazole-5-carboxamide
CID 110765475

Frequently Asked Questions

What is the IUPAC name of N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide?
The IUPAC name of N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide (CID 59833886) is N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide.
What is the SMILES notation for N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide?
The canonical SMILES for N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide is Cn1c(=O)c(-c2c(Cl)ccc(NC(=O)c3ccccc3)c2Cl)cc2cnccc21.
What is the InChIKey of N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide?
The InChIKey is SYTXERXNZCFTBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15Cl2N3O2/c1-27-18-9-10-25-12-14(18)11-15(22(27)29)19-16(23)7-8-17(20(19)24)26-21(28)13-5-3-2-4-6-13/h2-12H,1H3,(H,26,28).
What are the key properties of N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide?
N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide has a molecular weight of 424.29 g/mol, XLogP of 5.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-dichloro-3-(1-methyl-2-oxo-1,6-naphthyridin-3-yl)phenyl]benzamide is sourced from PubChem (CID 59833886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).