2-(2-phenylethyl)-N-prop-2-enylbenzamide

C18H19NO — CID 2228922

IUPAC2-(2-phenylethyl)-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1CCc1ccccc1
InChIInChI=1S/C18H19NO/c1-2-14-19-18(20)17-11-7-6-10-16(17)13-12-15-8-4-3-5-9-15/h2-11H,1,12-14H2,(H,19,20)
InChIKeyUSSWXYDMHVJJQW-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.39
Rot. Bonds6

About 2-(2-phenylethyl)-N-prop-2-enylbenzamide

2-(2-phenylethyl)-N-prop-2-enylbenzamide (PubChem CID 2228922) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-(2-phenylethyl)-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2-(2-phenylethyl)-N-prop-2-enylbenzamide
PubChem CID2228922
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name2-(2-phenylethyl)-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1ccccc1CCc1ccccc1
InChIInChI=1S/C18H19NO/c1-2-14-19-18(20)17-11-7-6-10-16(17)13-12-15-8-4-3-5-9-15/h2-11H,1,12-14H2,(H,19,20)
InChIKeyUSSWXYDMHVJJQW-UHFFFAOYSA-N
XLogP3.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(methylamino)ethyl]-N-prop-2-enylbenzamide
CID 104547357
N-[2-(dimethylamino)ethyl]-2-(2-phenylethyl)benzamide
CID 71396924
2-(phenoxymethyl)-N-prop-2-enylbenzamide
CID 9399802
2-[(2-phenylacetyl)amino]-N-prop-2-enylbenzamide
CID 3915249
2-[2-oxo-2-(prop-2-enylamino)ethyl]benzoic acid
CID 115923567
N-[2-(ethylamino)ethyl]-2-(2-phenylethyl)benzamide;hydrochloride
CID 119507829
2-fluoro-N-prop-2-enylbenzamide
CID 4125319
N-[2-(methylamino)propyl]-2-(2-phenylethyl)benzamide;hydrochloride
CID 120831456
5-(2-phenylethyl)-N-prop-2-enyl-1,3,4-oxadiazole-2-carboxamide
CID 110393366
N-[2-(4-chloroanilino)-2-oxoethyl]-2-(2-phenylethyl)benzamide
CID 52741879
N-(2-phenylethyl)-N'-prop-2-enyloxamide
CID 2058117
N-[2-oxo-2-(prop-2-enylamino)ethyl]-2-phenylacetamide
CID 9442349

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenylethyl)-N-prop-2-enylbenzamide?
The IUPAC name of 2-(2-phenylethyl)-N-prop-2-enylbenzamide (CID 2228922) is 2-(2-phenylethyl)-N-prop-2-enylbenzamide.
What is the SMILES notation for 2-(2-phenylethyl)-N-prop-2-enylbenzamide?
The canonical SMILES for 2-(2-phenylethyl)-N-prop-2-enylbenzamide is C=CCNC(=O)c1ccccc1CCc1ccccc1.
What is the InChIKey of 2-(2-phenylethyl)-N-prop-2-enylbenzamide?
The InChIKey is USSWXYDMHVJJQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-2-14-19-18(20)17-11-7-6-10-16(17)13-12-15-8-4-3-5-9-15/h2-11H,1,12-14H2,(H,19,20).
What are the key properties of 2-(2-phenylethyl)-N-prop-2-enylbenzamide?
2-(2-phenylethyl)-N-prop-2-enylbenzamide has a molecular weight of 265.36 g/mol, XLogP of 3.39, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenylethyl)-N-prop-2-enylbenzamide is sourced from PubChem (CID 2228922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).