N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide

C23H20ClNO — CID 162406418

IUPACN-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide
SMILESCC(=O)N(C/C(=C\c1ccccc1)c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C23H20ClNO/c1-18(26)25(23-10-6-3-7-11-23)17-21(16-19-8-4-2-5-9-19)20-12-14-22(24)15-13-20/h2-16H,17H2,1H3/b21-16+
InChIKeyOUWIMTMTZQEYLD-LTGZKZEYSA-N
MW361.87 g/mol
LogP5.93
Rot. Bonds5

About N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide

N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide (PubChem CID 162406418) has the molecular formula C23H20ClNO and a molecular weight of 361.87 g/mol. Its IUPAC name is N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide.

Molecular Properties

Compound NameN-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide
PubChem CID162406418
Molecular FormulaC23H20ClNO
Molecular Weight361.87 g/mol
Exact Mass361.12
IUPAC NameN-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide
SMILESCC(=O)N(C/C(=C\c1ccccc1)c1ccc(Cl)cc1)c1ccccc1
InChIInChI=1S/C23H20ClNO/c1-18(26)25(23-10-6-3-7-11-23)17-21(16-19-8-4-2-5-9-19)20-12-14-22(24)15-13-20/h2-16H,17H2,1H3/b21-16+
InChIKeyOUWIMTMTZQEYLD-LTGZKZEYSA-N
XLogP5.93
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.87
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-4-[(E)-1-phenylbut-1-en-2-yl]benzene
CID 138980853
methyl (Z)-2-[(N-acetylanilino)methyl]-3-phenylprop-2-enoate
CID 102456395
1-chloro-4-[(E)-2-phenylbut-1-enyl]benzene
CID 72793482
N-(4-chlorophenyl)-N-[2-(4-formylpiperazin-1-yl)-2-oxoethyl]acetamide
CID 113171494
N-benzyl-4-chloro-N-phenylbenzamide
CID 20787883
N-[2-(N-acetyl-4-chloroanilino)ethyl]benzamide
CID 113059617
methyl (E)-2-(4-chlorobenzoyl)-3-phenylprop-2-enoate
CID 24808600
(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enoate
CID 7063195
2-(4-chlorophenyl)-N-methyl-2-oxo-N-phenylacetamide
CID 13109495
N-[(E)-2,3-diphenylprop-2-enyl]-N-methylformamide
CID 101473048
(E)-3-(4-chlorophenyl)-N-[2-(N-[(E)-3-(4-chlorophenyl)prop-2-enoyl]anilino)ethyl]-N-phenylprop-2-enamide
CID 17195945
3-[(4-chlorophenyl)methyl]-4-phenylbut-3-en-2-one
CID 150479979

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide?
The IUPAC name of N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide (CID 162406418) is N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide.
What is the SMILES notation for N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide?
The canonical SMILES for N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide is CC(=O)N(C/C(=C\c1ccccc1)c1ccc(Cl)cc1)c1ccccc1.
What is the InChIKey of N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide?
The InChIKey is OUWIMTMTZQEYLD-LTGZKZEYSA-N. The full InChI is InChI=1S/C23H20ClNO/c1-18(26)25(23-10-6-3-7-11-23)17-21(16-19-8-4-2-5-9-19)20-12-14-22(24)15-13-20/h2-16H,17H2,1H3/b21-16+.
What are the key properties of N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide?
N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide has a molecular weight of 361.87 g/mol, XLogP of 5.93, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-(4-chlorophenyl)-3-phenylprop-2-enyl]-N-phenylacetamide is sourced from PubChem (CID 162406418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).