2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide

C17H13NO4 — CID 735033

IUPAC2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide
SMILESNC(=O)COc1c(-c2ccccc2)oc2ccccc2c1=O
InChIInChI=1S/C17H13NO4/c18-14(19)10-21-17-15(20)12-8-4-5-9-13(12)22-16(17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,18,19)
InChIKeyMTYLQYPQIDSGMA-UHFFFAOYSA-N
MW295.29 g/mol
LogP2.32
Rot. Bonds4

About 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide

2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide (PubChem CID 735033) has the molecular formula C17H13NO4 and a molecular weight of 295.29 g/mol. Its IUPAC name is 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide.

Molecular Properties

Compound Name2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide
PubChem CID735033
Molecular FormulaC17H13NO4
Molecular Weight295.29 g/mol
Exact Mass295.08
IUPAC Name2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide
SMILESNC(=O)COc1c(-c2ccccc2)oc2ccccc2c1=O
InChIInChI=1S/C17H13NO4/c18-14(19)10-21-17-15(20)12-8-4-5-9-13(12)22-16(17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,18,19)
InChIKeyMTYLQYPQIDSGMA-UHFFFAOYSA-N
XLogP2.32
TPSA82.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide?
The IUPAC name of 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide (CID 735033) is 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide.
What is the SMILES notation for 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide?
The canonical SMILES for 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide is NC(=O)COc1c(-c2ccccc2)oc2ccccc2c1=O.
What is the InChIKey of 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide?
The InChIKey is MTYLQYPQIDSGMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO4/c18-14(19)10-21-17-15(20)12-8-4-5-9-13(12)22-16(17)11-6-2-1-3-7-11/h1-9H,10H2,(H2,18,19).
What are the key properties of 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide?
2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide has a molecular weight of 295.29 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-oxo-2-phenylchromen-3-yl)oxyacetamide is sourced from PubChem (CID 735033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).