2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide

C23H22N4O3 — CID 110831750

IUPAC2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CN1C(=O)C(c2ccccc2)Oc2ccc(N)nc21)c1ccccc1
InChIInChI=1S/C23H22N4O3/c1-15(16-8-4-2-5-9-16)25-20(28)14-27-22-18(12-13-19(24)26-22)30-21(23(27)29)17-10-6-3-7-11-17/h2-13,15,21H,14H2,1H3,(H2,24,26)(H,25,28)
InChIKeyAAYQWKFCQVENNZ-UHFFFAOYSA-N
MW402.45 g/mol
LogP3.01
Rot. Bonds5

About 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide

2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide (PubChem CID 110831750) has the molecular formula C23H22N4O3 and a molecular weight of 402.45 g/mol. Its IUPAC name is 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide
PubChem CID110831750
Molecular FormulaC23H22N4O3
Molecular Weight402.45 g/mol
Exact Mass402.17
IUPAC Name2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide
SMILESCC(NC(=O)CN1C(=O)C(c2ccccc2)Oc2ccc(N)nc21)c1ccccc1
InChIInChI=1S/C23H22N4O3/c1-15(16-8-4-2-5-9-16)25-20(28)14-27-22-18(12-13-19(24)26-22)30-21(23(27)29)17-10-6-3-7-11-17/h2-13,15,21H,14H2,1H3,(H2,24,26)(H,25,28)
InChIKeyAAYQWKFCQVENNZ-UHFFFAOYSA-N
XLogP3.01
TPSA97.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.45
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide with MolForge

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Related Compounds

2-(3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide
CID 126458716
2-(3-aminopyrazol-1-yl)-N-[(1R)-1-phenylethyl]acetamide
CID 107863852
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-[(1R)-1-phenylethyl]acetamide
CID 7266427
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(1-phenylethyl)acetamide
CID 51139063
2-[(4R)-4-(2-methylpropyl)-2,5-dioxoimidazolidin-1-yl]-N-[(1R)-1-phenylethyl]acetamide
CID 2704316
2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-[(1S)-1-phenylethyl]acetamide
CID 7415935
2-(3-oxo-1,4-benzoxazin-4-yl)-N-(1-phenylethyl)acetamide
CID 3239944
2-(5-amino-2-oxo-1-pyridinyl)-N-(1-phenylethyl)acetamide
CID 62816679
N-[(1R)-1-phenylethyl]-2-(2,4,5-trioxo-3-propan-2-ylimidazolidin-1-yl)acetamide
CID 7975986
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 8014784
2-(4,4-dicyclopropyl-2,5-dioxoimidazolidin-1-yl)-N-[(1S)-1-phenylethyl]acetamide
CID 94813820
N-(1-phenylethyl)-2-pyrrol-1-ylacetamide
CID 20880526

Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide (CID 110831750) is 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide is CC(NC(=O)CN1C(=O)C(c2ccccc2)Oc2ccc(N)nc21)c1ccccc1.
What is the InChIKey of 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide?
The InChIKey is AAYQWKFCQVENNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O3/c1-15(16-8-4-2-5-9-16)25-20(28)14-27-22-18(12-13-19(24)26-22)30-21(23(27)29)17-10-6-3-7-11-17/h2-13,15,21H,14H2,1H3,(H2,24,26)(H,25,28).
What are the key properties of 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide?
2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide has a molecular weight of 402.45 g/mol, XLogP of 3.01, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-amino-3-oxo-2-phenylpyrido[3,2-b][1,4]oxazin-4-yl)-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 110831750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).