2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide

C20H16N4O4 — CID 11538073

IUPAC2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide
SMILESO=C(CNc1ccc(Oc2ccnc3[nH]c(=O)oc23)cc1)Nc1ccccc1
InChIInChI=1S/C20H16N4O4/c25-17(23-14-4-2-1-3-5-14)12-22-13-6-8-15(9-7-13)27-16-10-11-21-19-18(16)28-20(26)24-19/h1-11,22H,12H2,(H,23,25)(H,21,24,26)
InChIKeyNMZNLEBBXFXERQ-UHFFFAOYSA-N
MW376.37 g/mol
LogP3.36
Rot. Bonds6

About 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide

2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide (PubChem CID 11538073) has the molecular formula C20H16N4O4 and a molecular weight of 376.37 g/mol. Its IUPAC name is 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide.

Molecular Properties

Compound Name2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide
PubChem CID11538073
Molecular FormulaC20H16N4O4
Molecular Weight376.37 g/mol
Exact Mass376.12
IUPAC Name2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide
SMILESO=C(CNc1ccc(Oc2ccnc3[nH]c(=O)oc23)cc1)Nc1ccccc1
InChIInChI=1S/C20H16N4O4/c25-17(23-14-4-2-1-3-5-14)12-22-13-6-8-15(9-7-13)27-16-10-11-21-19-18(16)28-20(26)24-19/h1-11,22H,12H2,(H,23,25)(H,21,24,26)
InChIKeyNMZNLEBBXFXERQ-UHFFFAOYSA-N
XLogP3.36
TPSA109.25 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.37
LogP ≤ 53.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(2-phenoxyethoxy)anilino]-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 54823077
2-(4-methoxyanilino)-N-phenylacetamide
CID 7636829
N-(4-bromophenyl)-2-[4-(2-phenoxyethoxy)anilino]acetamide
CID 54821631
N-(3-acetamidophenyl)-2-(4-phenoxyanilino)acetamide
CID 54812613
N-(5-methyl-1,2-oxazol-3-yl)-2-(4-phenoxyanilino)acetamide
CID 39912338
2-(3-fluoroanilino)-N-(4-phenoxyphenyl)acetamide
CID 9098919
2-(4-heptoxyanilino)-N-(4-phenoxyphenyl)acetamide
CID 54821713
N-[4-[[2-oxo-2-[4-(2-phenoxyethoxy)anilino]ethyl]amino]phenyl]propanamide
CID 54835679
N-(4-methoxyphenyl)-2-[4-(2-phenoxyethoxy)anilino]acetamide
CID 54823074
N-(3-acetylphenyl)-2-(4-phenoxyanilino)acetamide
CID 109009860
N-(4-phenoxyphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 55362283
2-anilino-N-(4-pyridin-4-ylphenyl)acetamide
CID 15981382

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide?
The IUPAC name of 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide (CID 11538073) is 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide.
What is the SMILES notation for 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide?
The canonical SMILES for 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide is O=C(CNc1ccc(Oc2ccnc3[nH]c(=O)oc23)cc1)Nc1ccccc1.
What is the InChIKey of 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide?
The InChIKey is NMZNLEBBXFXERQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O4/c25-17(23-14-4-2-1-3-5-14)12-22-13-6-8-15(9-7-13)27-16-10-11-21-19-18(16)28-20(26)24-19/h1-11,22H,12H2,(H,23,25)(H,21,24,26).
What are the key properties of 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide?
2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide has a molecular weight of 376.37 g/mol, XLogP of 3.36, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2-oxo-3H-[1,3]oxazolo[4,5-b]pyridin-7-yl)oxy]anilino]-N-phenylacetamide is sourced from PubChem (CID 11538073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).