2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide

C21H19NO2 — CID 112795612

IUPAC2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide
SMILESC=CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C21H19NO2/c1-2-15-22(18-11-4-3-5-12-18)21(23)16-24-20-14-8-10-17-9-6-7-13-19(17)20/h2-14H,1,15-16H2
InChIKeySUBPPROMSNNXNB-UHFFFAOYSA-N
MW317.39 g/mol
LogP4.44
Rot. Bonds6

About 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide

2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide (PubChem CID 112795612) has the molecular formula C21H19NO2 and a molecular weight of 317.39 g/mol. Its IUPAC name is 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide
PubChem CID112795612
Molecular FormulaC21H19NO2
Molecular Weight317.39 g/mol
Exact Mass317.14
IUPAC Name2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide
SMILESC=CCN(C(=O)COc1cccc2ccccc12)c1ccccc1
InChIInChI=1S/C21H19NO2/c1-2-15-22(18-11-4-3-5-12-18)21(23)16-24-20-14-8-10-17-9-6-7-13-19(17)20/h2-14H,1,15-16H2
InChIKeySUBPPROMSNNXNB-UHFFFAOYSA-N
XLogP4.44
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-oxo-2-(N-prop-2-enylanilino)ethyl] naphthalene-1-carboxylate
CID 9290194
2-(2-nitrophenoxy)-N-phenyl-N-prop-2-enylacetamide
CID 78812401
2-(1-bromonaphthalen-2-yl)oxy-N,N-bis(prop-2-enyl)acetamide
CID 112774907
[2-oxo-2-(N-prop-2-enylanilino)ethyl] 2-methylquinoline-4-carboxylate
CID 8577361
[2-oxo-2-(N-prop-2-enylanilino)ethyl] 2,4-dimethylquinoline-3-carboxylate
CID 8825442
N-(cyanomethyl)-2-(1-formylnaphthalen-2-yl)oxy-N-phenylacetamide
CID 38899195
2-(2-ethoxyphenoxy)-N-ethyl-N-naphthalen-1-ylacetamide
CID 112779417
N-cyclopentyl-N-cyclopropyl-2-naphthalen-1-yloxyacetamide
CID 112818381
1-[(2-naphthalen-1-yloxyacetyl)amino]-1-phenylurea
CID 22299122
N-(cyanomethyl)-2-(2-formylphenoxy)-N-phenylacetamide
CID 30834008
3-(4-methoxyphenyl)-N-phenyl-N-prop-2-enylpropanamide
CID 52564357
2,2,2-trichloro-N-phenyl-N-prop-2-enylacetamide
CID 10901943

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide?
The IUPAC name of 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide (CID 112795612) is 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide.
What is the SMILES notation for 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide?
The canonical SMILES for 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide is C=CCN(C(=O)COc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide?
The InChIKey is SUBPPROMSNNXNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2/c1-2-15-22(18-11-4-3-5-12-18)21(23)16-24-20-14-8-10-17-9-6-7-13-19(17)20/h2-14H,1,15-16H2.
What are the key properties of 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide?
2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide has a molecular weight of 317.39 g/mol, XLogP of 4.44, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yloxy-N-phenyl-N-prop-2-enylacetamide is sourced from PubChem (CID 112795612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).