2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide

C19H19NO4 — CID 17448836

IUPAC2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
SMILESCC(=O)c1cccc(OCC(=O)NC2CCOc3ccccc32)c1
InChIInChI=1S/C19H19NO4/c1-13(21)14-5-4-6-15(11-14)24-12-19(22)20-17-9-10-23-18-8-3-2-7-16(17)18/h2-8,11,17H,9-10,12H2,1H3,(H,20,22)
InChIKeyDYCNAEZKCOKNFQ-UHFFFAOYSA-N
MW325.36 g/mol
LogP2.91
Rot. Bonds5

About 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide

2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide (PubChem CID 17448836) has the molecular formula C19H19NO4 and a molecular weight of 325.36 g/mol. Its IUPAC name is 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide.

Molecular Properties

Compound Name2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
PubChem CID17448836
Molecular FormulaC19H19NO4
Molecular Weight325.36 g/mol
Exact Mass325.13
IUPAC Name2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
SMILESCC(=O)c1cccc(OCC(=O)NC2CCOc3ccccc32)c1
InChIInChI=1S/C19H19NO4/c1-13(21)14-5-4-6-15(11-14)24-12-19(22)20-17-9-10-23-18-8-3-2-7-16(17)18/h2-8,11,17H,9-10,12H2,1H3,(H,20,22)
InChIKeyDYCNAEZKCOKNFQ-UHFFFAOYSA-N
XLogP2.91
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.36
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3,4-dichlorophenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 46828800
3-[3-[[(4S)-3,4-dihydro-2H-chromen-4-yl]amino]-3-oxopropoxy]benzamide
CID 95974632
N-(3,4-dihydro-2H-chromen-4-yl)-2-(3-methyl-4-propan-2-ylphenoxy)acetamide
CID 18193059
[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 3-acetamidobenzoate
CID 17397287
N-(3,4-dihydro-2H-chromen-4-yl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 47008000
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-(3-methyl-4-nitrophenoxy)acetamide
CID 35338499
2-(3-acetylphenoxy)-N-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)acetamide
CID 86923871
N-(3,4-dihydro-2H-chromen-4-yl)-2-[4-(dimethylsulfamoyl)phenoxy]acetamide
CID 46978872
2-(3-acetylphenoxy)-N-cyclohexylacetamide
CID 2708999
4-[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethoxy]-3-methoxybenzoic acid
CID 45397810
2-(2,3-dichlorophenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 46829045
2-(2-bromo-4-methylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 18196743

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide?
The IUPAC name of 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide (CID 17448836) is 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide.
What is the SMILES notation for 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide?
The canonical SMILES for 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide is CC(=O)c1cccc(OCC(=O)NC2CCOc3ccccc32)c1.
What is the InChIKey of 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide?
The InChIKey is DYCNAEZKCOKNFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO4/c1-13(21)14-5-4-6-15(11-14)24-12-19(22)20-17-9-10-23-18-8-3-2-7-16(17)18/h2-8,11,17H,9-10,12H2,1H3,(H,20,22).
What are the key properties of 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide?
2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide has a molecular weight of 325.36 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylphenoxy)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide is sourced from PubChem (CID 17448836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).