2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide

C20H19NO4 — CID 166604353

IUPAC2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide
SMILESCCCc1cc2c(-c3ccccc3)cc(=O)oc2cc1OCC(N)=O
InChIInChI=1S/C20H19NO4/c1-2-6-14-9-16-15(13-7-4-3-5-8-13)10-20(23)25-18(16)11-17(14)24-12-19(21)22/h3-5,7-11H,2,6,12H2,1H3,(H2,21,22)
InChIKeyYQPRAZGDLJMHIP-UHFFFAOYSA-N
MW337.38 g/mol
LogP3.28
Rot. Bonds6

About 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide

2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide (PubChem CID 166604353) has the molecular formula C20H19NO4 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide.

Molecular Properties

Compound Name2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide
PubChem CID166604353
Molecular FormulaC20H19NO4
Molecular Weight337.38 g/mol
Exact Mass337.13
IUPAC Name2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide
SMILESCCCc1cc2c(-c3ccccc3)cc(=O)oc2cc1OCC(N)=O
InChIInChI=1S/C20H19NO4/c1-2-6-14-9-16-15(13-7-4-3-5-8-13)10-20(23)25-18(16)11-17(14)24-12-19(21)22/h3-5,7-11H,2,6,12H2,1H3,(H2,21,22)
InChIKeyYQPRAZGDLJMHIP-UHFFFAOYSA-N
XLogP3.28
TPSA82.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

2-(6-hexyl-2-oxo-4-phenylchromen-7-yl)oxyacetic acid
CID 3664205
2-(6-hexyl-2-oxo-4-phenylchromen-7-yl)oxyacetate
CID 7150050
7-ethoxy-6-ethyl-4-phenylchromen-2-one
CID 2888002
2-[5-(2-amino-2-oxoethoxy)-2-oxo-4-phenylchromen-7-yl]oxyacetamide
CID 166604349
2-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxy-N-(3-hydroxypropyl)acetamide
CID 4911631
tert-butyl 2-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxyacetate
CID 988856
2-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxy-N-[3-(dimethylamino)propyl]acetamide
CID 4910456
N-[(2R)-1-hydroxypropan-2-yl]-3-(7-methoxy-2-oxo-4-phenylchromen-6-yl)propanamide
CID 100906391
N-[(2R)-1-hydroxy-3-methylbutan-2-yl]-3-(7-methoxy-2-oxo-4-phenylchromen-6-yl)propanamide
CID 100905721
2-[[2-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxyacetyl]amino]thiophene-3-carboxamide
CID 24523373
2-(6-chloro-2-oxo-4-phenylchromen-7-yl)oxy-N-ethylpropanamide
CID 24520454
7-ethoxy-4-phenylchromen-2-one
CID 678937

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide?
The IUPAC name of 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide (CID 166604353) is 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide.
What is the SMILES notation for 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide?
The canonical SMILES for 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide is CCCc1cc2c(-c3ccccc3)cc(=O)oc2cc1OCC(N)=O.
What is the InChIKey of 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide?
The InChIKey is YQPRAZGDLJMHIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO4/c1-2-6-14-9-16-15(13-7-4-3-5-8-13)10-20(23)25-18(16)11-17(14)24-12-19(21)22/h3-5,7-11H,2,6,12H2,1H3,(H2,21,22).
What are the key properties of 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide?
2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide has a molecular weight of 337.38 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-4-phenyl-6-propylchromen-7-yl)oxyacetamide is sourced from PubChem (CID 166604353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).