2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide

C21H16N4O2 — CID 10155193

IUPAC2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide
SMILESNC(=O)c1cc2c(cn1)c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C21H16N4O2/c22-21(27)17-11-18-16(13-23-17)19(26)12-20(24-14-7-3-1-4-8-14)25(18)15-9-5-2-6-10-15/h1-13,24H,(H2,22,27)
InChIKeyHYOJUQRXAAEGMZ-UHFFFAOYSA-N
MW356.39 g/mol
LogP3.23
Rot. Bonds4

About 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide

2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide (PubChem CID 10155193) has the molecular formula C21H16N4O2 and a molecular weight of 356.39 g/mol. Its IUPAC name is 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide.

Molecular Properties

Compound Name2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide
PubChem CID10155193
Molecular FormulaC21H16N4O2
Molecular Weight356.39 g/mol
Exact Mass356.13
IUPAC Name2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide
SMILESNC(=O)c1cc2c(cn1)c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C21H16N4O2/c22-21(27)17-11-18-16(13-23-17)19(26)12-20(24-14-7-3-1-4-8-14)25(18)15-9-5-2-6-10-15/h1-13,24H,(H2,22,27)
InChIKeyHYOJUQRXAAEGMZ-UHFFFAOYSA-N
XLogP3.23
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.39
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide?
The IUPAC name of 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide (CID 10155193) is 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide.
What is the SMILES notation for 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide?
The canonical SMILES for 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide is NC(=O)c1cc2c(cn1)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.
What is the InChIKey of 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide?
The InChIKey is HYOJUQRXAAEGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4O2/c22-21(27)17-11-18-16(13-23-17)19(26)12-20(24-14-7-3-1-4-8-14)25(18)15-9-5-2-6-10-15/h1-13,24H,(H2,22,27).
What are the key properties of 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide?
2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide has a molecular weight of 356.39 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide is sourced from PubChem (CID 10155193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).