4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide

C22H17N3O4 — CID 54715430

IUPAC4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1c(O)c2cccnc2n(-c2ccccc2)c1=O
InChIInChI=1S/C22H17N3O4/c1-29-17-12-6-5-11-16(17)24-21(27)18-19(26)15-10-7-13-23-20(15)25(22(18)28)14-8-3-2-4-9-14/h2-13,26H,1H3,(H,24,27)
InChIKeyNRBFECMCSGEVFI-UHFFFAOYSA-N
MW387.40 g/mol
LogP3.35
Rot. Bonds4

About 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide

4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide (PubChem CID 54715430) has the molecular formula C22H17N3O4 and a molecular weight of 387.40 g/mol. Its IUPAC name is 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide
PubChem CID54715430
Molecular FormulaC22H17N3O4
Molecular Weight387.40 g/mol
Exact Mass387.12
IUPAC Name4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1c(O)c2cccnc2n(-c2ccccc2)c1=O
InChIInChI=1S/C22H17N3O4/c1-29-17-12-6-5-11-16(17)24-21(27)18-19(26)15-10-7-13-23-20(15)25(22(18)28)14-8-3-2-4-9-14/h2-13,26H,1H3,(H,24,27)
InChIKeyNRBFECMCSGEVFI-UHFFFAOYSA-N
XLogP3.35
TPSA93.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.40
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide (CID 54715430) is 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide is COc1ccccc1NC(=O)c1c(O)c2cccnc2n(-c2ccccc2)c1=O.
What is the InChIKey of 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide?
The InChIKey is NRBFECMCSGEVFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O4/c1-29-17-12-6-5-11-16(17)24-21(27)18-19(26)15-10-7-13-23-20(15)25(22(18)28)14-8-3-2-4-9-14/h2-13,26H,1H3,(H,24,27).
What are the key properties of 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide?
4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide has a molecular weight of 387.40 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-methoxyphenyl)-2-oxo-1-phenyl-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 54715430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).