6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide

C23H18FN3O2 — CID 46339999

IUPAC6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
SMILESCc1nc2ccn(Cc3ccccc3)c(=O)c2cc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C23H18FN3O2/c1-15-19(22(28)26-18-9-7-17(24)8-10-18)13-20-21(25-15)11-12-27(23(20)29)14-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,26,28)
InChIKeyDDHIRVXZZQNGAF-UHFFFAOYSA-N
MW387.41 g/mol
LogP4.14
Rot. Bonds4

About 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide

6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide (PubChem CID 46339999) has the molecular formula C23H18FN3O2 and a molecular weight of 387.41 g/mol. Its IUPAC name is 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
PubChem CID46339999
Molecular FormulaC23H18FN3O2
Molecular Weight387.41 g/mol
Exact Mass387.14
IUPAC Name6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
SMILESCc1nc2ccn(Cc3ccccc3)c(=O)c2cc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C23H18FN3O2/c1-15-19(22(28)26-18-9-7-17(24)8-10-18)13-20-21(25-15)11-12-27(23(20)29)14-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,26,28)
InChIKeyDDHIRVXZZQNGAF-UHFFFAOYSA-N
XLogP4.14
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.41
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-benzyl-2-methyl-N-(3-methylsulfanylphenyl)-5-oxo-1,6-naphthyridine-3-carboxamide
CID 20947021
6-benzyl-N-(2,5-dimethylphenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 20947019
6-[(4-methoxyphenyl)methyl]-2-methyl-N-(2-methylphenyl)-5-oxo-1,6-naphthyridine-3-carboxamide
CID 46339843
6-benzyl-2-methyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-oxo-1,6-naphthyridine-3-carboxamide
CID 169248825
6-[(4-chlorophenyl)methyl]-N-[(5-fluoro-2-pyridinyl)methyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 169248867
6-[(3-fluorophenyl)methyl]-2-methyl-N-[(2-methyl-1,3-oxazol-4-yl)methyl]-5-oxo-1,6-naphthyridine-3-carboxamide
CID 169248733
N-[(4-chlorophenyl)methyl]-6-(furan-2-ylmethyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide;N-[(4-chlorophenyl)methyl]-2-methyl-5-oxo-6-(pyridin-3-ylmethyl)-1,6-naphthyridine-3-carboxamide;N-(4-fluorophenyl)-6-[2-[4-(methoxymethyl)phenyl]ethyl]-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 160853592
N-(4-fluorophenyl)-1-[(4-methylphenyl)methyl]-2-oxopyridine-3-carboxamide
CID 7598726
6-[(4-chloro-3-fluorophenyl)methyl]-2-methyl-5-oxo-N-(pyridin-2-ylmethyl)-1,6-naphthyridine-3-carboxamide
CID 170306689
6-(2-methoxyethyl)-2-methyl-N-(3-methylphenyl)-5-oxo-1,6-naphthyridine-3-carboxamide
CID 46339963
6-(2-methoxyethyl)-N-(2-methoxyphenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide
CID 46339967
2-methyl-5-oxo-N-(pyridin-2-ylmethyl)-6-(pyridin-3-ylmethyl)-1,6-naphthyridine-3-carboxamide
CID 169248748

Frequently Asked Questions

What is the IUPAC name of 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?
The IUPAC name of 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide (CID 46339999) is 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide.
What is the SMILES notation for 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?
The canonical SMILES for 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide is Cc1nc2ccn(Cc3ccccc3)c(=O)c2cc1C(=O)Nc1ccc(F)cc1.
What is the InChIKey of 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?
The InChIKey is DDHIRVXZZQNGAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FN3O2/c1-15-19(22(28)26-18-9-7-17(24)8-10-18)13-20-21(25-15)11-12-27(23(20)29)14-16-5-3-2-4-6-16/h2-13H,14H2,1H3,(H,26,28).
What are the key properties of 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide?
6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide has a molecular weight of 387.41 g/mol, XLogP of 4.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-benzyl-N-(4-fluorophenyl)-2-methyl-5-oxo-1,6-naphthyridine-3-carboxamide is sourced from PubChem (CID 46339999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).