N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide

C23H19NO4 — CID 2705109

IUPACN-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide
SMILESCCN(C(=O)COc1ccc2ccc(=O)oc2c1)c1cccc2ccccc12
InChIInChI=1S/C23H19NO4/c1-2-24(20-9-5-7-16-6-3-4-8-19(16)20)22(25)15-27-18-12-10-17-11-13-23(26)28-21(17)14-18/h3-14H,2,15H2,1H3
InChIKeyVSZZFEPAMDGCDH-UHFFFAOYSA-N
MW373.41 g/mol
LogP4.38
Rot. Bonds5

About N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide

N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide (PubChem CID 2705109) has the molecular formula C23H19NO4 and a molecular weight of 373.41 g/mol. Its IUPAC name is N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide.

Molecular Properties

Compound NameN-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide
PubChem CID2705109
Molecular FormulaC23H19NO4
Molecular Weight373.41 g/mol
Exact Mass373.13
IUPAC NameN-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide
SMILESCCN(C(=O)COc1ccc2ccc(=O)oc2c1)c1cccc2ccccc12
InChIInChI=1S/C23H19NO4/c1-2-24(20-9-5-7-16-6-3-4-8-19(16)20)22(25)15-27-18-12-10-17-11-13-23(26)28-21(17)14-18/h3-14H,2,15H2,1H3
InChIKeyVSZZFEPAMDGCDH-UHFFFAOYSA-N
XLogP4.38
TPSA59.75 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethyl 2-(2-oxochromen-7-yl)oxyacetate;hydrochloride
CID 88715232
2-(2-ethoxyphenoxy)-N-ethyl-N-naphthalen-1-ylacetamide
CID 112779417
7-(2-naphthalen-2-yl-2-oxoethoxy)chromen-2-one
CID 2292760
4-[[ethyl-[2-(2-oxochromen-7-yl)oxyacetyl]amino]methyl]-N,N-dimethylbenzamide
CID 56511803
7-(2-methylprop-2-enoxy)chromen-2-one
CID 875202
N-[(2S)-butan-2-yl]-2-(2-oxochromen-7-yl)oxyacetamide
CID 2705066
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-(2-oxochromen-7-yl)oxyacetamide
CID 119655442
N-cycloheptyl-N-methyl-2-(2-oxochromen-7-yl)oxyacetamide
CID 51287180
dimethylazanium;2-(2-oxochromen-7-yl)oxyacetate
CID 139081078
N-methyl-2-(2-oxochromen-7-yl)oxy-N-(quinoxalin-2-ylmethyl)acetamide
CID 171387743
N,N-dimethyl-3-[[[2-(2-oxochromen-7-yl)oxyacetyl]amino]methyl]benzamide
CID 46401405
N-[(4-bromophenyl)methyl]-N-methyl-2-(2-oxochromen-7-yl)oxyacetamide
CID 16504643

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide?
The IUPAC name of N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide (CID 2705109) is N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide.
What is the SMILES notation for N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide?
The canonical SMILES for N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide is CCN(C(=O)COc1ccc2ccc(=O)oc2c1)c1cccc2ccccc12.
What is the InChIKey of N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide?
The InChIKey is VSZZFEPAMDGCDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19NO4/c1-2-24(20-9-5-7-16-6-3-4-8-19(16)20)22(25)15-27-18-12-10-17-11-13-23(26)28-21(17)14-18/h3-14H,2,15H2,1H3.
What are the key properties of N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide?
N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide has a molecular weight of 373.41 g/mol, XLogP of 4.38, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-naphthalen-1-yl-2-(2-oxochromen-7-yl)oxyacetamide is sourced from PubChem (CID 2705109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).