N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide

C24H21N3O3 — CID 141331220

IUPACN-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2c[nH]c3ncc(-c4ccccc4C)cc3c2=O)c1
InChIInChI=1S/C24H21N3O3/c1-15-6-3-4-9-19(15)17-11-20-22(28)21(14-26-23(20)25-13-17)24(29)27-12-16-7-5-8-18(10-16)30-2/h3-11,13-14H,12H2,1-2H3,(H,27,29)(H,25,26,28)
InChIKeyFPNVOQJFDAEDQG-UHFFFAOYSA-N
MW399.45 g/mol
LogP3.84
Rot. Bonds5

About N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide

N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide (PubChem CID 141331220) has the molecular formula C24H21N3O3 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide
PubChem CID141331220
Molecular FormulaC24H21N3O3
Molecular Weight399.45 g/mol
Exact Mass399.16
IUPAC NameN-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide
SMILESCOc1cccc(CNC(=O)c2c[nH]c3ncc(-c4ccccc4C)cc3c2=O)c1
InChIInChI=1S/C24H21N3O3/c1-15-6-3-4-9-19(15)17-11-20-22(28)21(14-26-23(20)25-13-17)24(29)27-12-16-7-5-8-18(10-16)30-2/h3-11,13-14H,12H2,1-2H3,(H,27,29)(H,25,26,28)
InChIKeyFPNVOQJFDAEDQG-UHFFFAOYSA-N
XLogP3.84
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-6-methoxy-4-oxo-1H-quinoline-3-carboxamide
CID 18473067
4-amino-N-[(3-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
CID 81242597
2-iodo-N-[(3-methoxyphenyl)methyl]benzamide
CID 2468432
6-(diethylsulfamoyl)-N-[(3-methoxyphenyl)methyl]-4-oxo-1H-quinoline-3-carboxamide
CID 141331217
N-[(3-methoxyphenyl)methyl]-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112522336
N-[(3-methoxyphenyl)methyl]-5-(4-methylphenyl)-1H-pyrazole-4-carboxamide
CID 71824643
2-(2,6-dimethylphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 9495693
2-[5-[(3-methoxyphenyl)methylcarbamoyl]thiophen-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxylic acid
CID 90188040
3-hydroxy-N-[(3-methoxyphenyl)methyl]naphthalene-2-carboxamide
CID 27231686
N-[2-(3-methoxyphenyl)ethyl]-5-[(2-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109188265
2-chloro-N-[(3-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 24903460
2-(2,3-dimethylphenoxy)-N-[(3-methoxyphenyl)methyl]acetamide
CID 8921514

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide (CID 141331220) is N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide is COc1cccc(CNC(=O)c2c[nH]c3ncc(-c4ccccc4C)cc3c2=O)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide?
The InChIKey is FPNVOQJFDAEDQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O3/c1-15-6-3-4-9-19(15)17-11-20-22(28)21(14-26-23(20)25-13-17)24(29)27-12-16-7-5-8-18(10-16)30-2/h3-11,13-14H,12H2,1-2H3,(H,27,29)(H,25,26,28).
What are the key properties of N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide?
N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide has a molecular weight of 399.45 g/mol, XLogP of 3.84, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxyphenyl)methyl]-6-(2-methylphenyl)-4-oxo-1H-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 141331220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).