N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide

C22H21NO4 — CID 7641790

IUPACN-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
SMILESO=C(COc1ccc2c(=O)c(-c3ccccc3)coc2c1)NC1CCCC1
InChIInChI=1S/C22H21NO4/c24-21(23-16-8-4-5-9-16)14-26-17-10-11-18-20(12-17)27-13-19(22(18)25)15-6-2-1-3-7-15/h1-3,6-7,10-13,16H,4-5,8-9,14H2,(H,23,24)
InChIKeyDZYLJFPDWVZXCI-UHFFFAOYSA-N
MW363.41 g/mol
LogP3.90
Rot. Bonds5

About N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide

N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide (PubChem CID 7641790) has the molecular formula C22H21NO4 and a molecular weight of 363.41 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
PubChem CID7641790
Molecular FormulaC22H21NO4
Molecular Weight363.41 g/mol
Exact Mass363.15
IUPAC NameN-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
SMILESO=C(COc1ccc2c(=O)c(-c3ccccc3)coc2c1)NC1CCCC1
InChIInChI=1S/C22H21NO4/c24-21(23-16-8-4-5-9-16)14-26-17-10-11-18-20(12-17)27-13-19(22(18)25)15-6-2-1-3-7-15/h1-3,6-7,10-13,16H,4-5,8-9,14H2,(H,23,24)
InChIKeyDZYLJFPDWVZXCI-UHFFFAOYSA-N
XLogP3.90
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.41
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
CID 7641759
2-(4-oxo-3-phenylchromen-7-yl)oxyacetic acid
CID 15122627
N-cycloheptyl-2-(2-methyl-4-oxo-3-phenylchromen-7-yl)oxyacetamide
CID 9317092
7-[2-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethoxy]-3-phenylchromen-4-one
CID 7641848
7-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethoxy]-3-phenylchromen-4-one
CID 7641888
N-(4-fluorophenyl)-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
CID 1191267
2-(4-oxo-3-phenylchromen-7-yl)oxy-N-(2,4,6-trimethylphenyl)acetamide
CID 7641806
N-(1-hydroxy-3-methylbutan-2-yl)-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
CID 45371498
7-[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethoxy]-3-phenylchromen-4-one
CID 40919216
N-cyclohexyl-2-[3-(4-methoxyphenoxy)-4-oxochromen-7-yl]oxyacetamide
CID 1192171
N-(1-hydroxy-4-methylpentan-2-yl)-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide
CID 163082505
(4-oxo-3-phenylchromen-7-yl) 2-phenoxyacetate
CID 8913011

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide?
The IUPAC name of N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide (CID 7641790) is N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide.
What is the SMILES notation for N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide?
The canonical SMILES for N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide is O=C(COc1ccc2c(=O)c(-c3ccccc3)coc2c1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide?
The InChIKey is DZYLJFPDWVZXCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO4/c24-21(23-16-8-4-5-9-16)14-26-17-10-11-18-20(12-17)27-13-19(22(18)25)15-6-2-1-3-7-15/h1-3,6-7,10-13,16H,4-5,8-9,14H2,(H,23,24).
What are the key properties of N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide?
N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide has a molecular weight of 363.41 g/mol, XLogP of 3.90, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-oxo-3-phenylchromen-7-yl)oxyacetamide is sourced from PubChem (CID 7641790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).