4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide

C22H19NO2 — CID 17097892

IUPAC4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide
SMILESC=CCOc1ccccc1NC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H19NO2/c1-2-16-25-21-11-7-6-10-20(21)23-22(24)19-14-12-18(13-15-19)17-8-4-3-5-9-17/h2-15H,1,16H2,(H,23,24)
InChIKeyNNEOADXPKCLENI-UHFFFAOYSA-N
MW329.40 g/mol
LogP5.17
Rot. Bonds6

About 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide

4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide (PubChem CID 17097892) has the molecular formula C22H19NO2 and a molecular weight of 329.40 g/mol. Its IUPAC name is 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide.

Molecular Properties

Compound Name4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide
PubChem CID17097892
Molecular FormulaC22H19NO2
Molecular Weight329.40 g/mol
Exact Mass329.14
IUPAC Name4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide
SMILESC=CCOc1ccccc1NC(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C22H19NO2/c1-2-16-25-21-11-7-6-10-20(21)23-22(24)19-14-12-18(13-15-19)17-8-4-3-5-9-17/h2-15H,1,16H2,(H,23,24)
InChIKeyNNEOADXPKCLENI-UHFFFAOYSA-N
XLogP5.17
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.40
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-tert-butyl-N-(2-prop-2-enoxyphenyl)benzamide
CID 17097960
N-[2-(2-phenoxyethoxy)phenyl]-4-phenylbenzamide
CID 17130808
3-iodo-4-methyl-N-(2-prop-2-enoxyphenyl)benzamide
CID 17097969
N-[2-(3-phenylpropoxy)phenyl]-4-prop-2-enoxybenzamide
CID 17131462
N-[2-[2-(dimethylamino)ethoxy]phenyl]-4-phenylbenzamide
CID 18672579
4-phenyl-N-[(E)-(2-prop-2-enoxyphenyl)methylideneamino]benzamide
CID 54788843
2-phenylmethoxy-N-(2-prop-2-enoxyphenyl)benzamide
CID 17098011
4-chloro-N-[(2-prop-2-enoxyphenyl)carbamothioyl]benzamide
CID 17098233
2-(2-phenoxyethoxy)-N-(2-prop-2-enoxyphenyl)benzamide
CID 17098022
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-4-phenylbenzamide
CID 26522657
3-bromo-N-[2-(2-methylpropoxy)phenyl]-4-prop-2-enoxybenzamide
CID 17074334
2-(2-bromo-4-phenylphenoxy)-N-(2-prop-2-enoxyphenyl)acetamide
CID 17098032

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide?
The IUPAC name of 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide (CID 17097892) is 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide.
What is the SMILES notation for 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide?
The canonical SMILES for 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide is C=CCOc1ccccc1NC(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide?
The InChIKey is NNEOADXPKCLENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO2/c1-2-16-25-21-11-7-6-10-20(21)23-22(24)19-14-12-18(13-15-19)17-8-4-3-5-9-17/h2-15H,1,16H2,(H,23,24).
What are the key properties of 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide?
4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide has a molecular weight of 329.40 g/mol, XLogP of 5.17, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-N-(2-prop-2-enoxyphenyl)benzamide is sourced from PubChem (CID 17097892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).