2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide

C21H16ClNO — CID 154711016

IUPAC2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide
SMILESC=C(c1ccc(Cl)cc1)c1ccccc1C(=O)Nc1ccccc1
InChIInChI=1S/C21H16ClNO/c1-15(16-11-13-17(22)14-12-16)19-9-5-6-10-20(19)21(24)23-18-7-3-2-4-8-18/h2-14H,1H2,(H,23,24)
InChIKeyAQZZUWACJQSKFQ-UHFFFAOYSA-N
MW333.82 g/mol
LogP5.65
Rot. Bonds4

About 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide

2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide (PubChem CID 154711016) has the molecular formula C21H16ClNO and a molecular weight of 333.82 g/mol. Its IUPAC name is 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide
PubChem CID154711016
Molecular FormulaC21H16ClNO
Molecular Weight333.82 g/mol
Exact Mass333.09
IUPAC Name2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide
SMILESC=C(c1ccc(Cl)cc1)c1ccccc1C(=O)Nc1ccccc1
InChIInChI=1S/C21H16ClNO/c1-15(16-11-13-17(22)14-12-16)19-9-5-6-10-20(19)21(24)23-18-7-3-2-4-8-18/h2-14H,1H2,(H,23,24)
InChIKeyAQZZUWACJQSKFQ-UHFFFAOYSA-N
XLogP5.65
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.82
LogP ≤ 55.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
2-(4-chlorobenzoyl)-N-(4-phenyldiazenylphenyl)benzamide
CID 165365429
2-(4-chlorophenyl)-N-phenylbenzamide
CID 102340259
N-(4-anilinophenyl)-4-chlorobenzamide
CID 681104
N-(4-chlorophenyl)benzamide;hydrochloride
CID 139912610
2-[(4-chlorophenyl)methylideneamino]-N-phenylbenzamide
CID 693562
N-[4-[[(4-chlorobenzoyl)amino]carbamoyl]phenyl]benzamide
CID 1100705
2-[(4-carboxyphenyl)carbamoyl]benzoic acid
CID 746560
2-(phenylcarbamoyl)benzenecarbothioic S-acid
CID 118007964
2,3-dichloro-N-phenylbenzamide
CID 7732866
2-hydroxy-N-phenylbenzamide
CID 157209959
4-chloro-1-N-[(4-chlorophenyl)methyl]-3-N-phenylbenzene-1,3-dicarboxamide
CID 171355386

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide?
The IUPAC name of 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide (CID 154711016) is 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide.
What is the SMILES notation for 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide?
The canonical SMILES for 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide is C=C(c1ccc(Cl)cc1)c1ccccc1C(=O)Nc1ccccc1.
What is the InChIKey of 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide?
The InChIKey is AQZZUWACJQSKFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClNO/c1-15(16-11-13-17(22)14-12-16)19-9-5-6-10-20(19)21(24)23-18-7-3-2-4-8-18/h2-14H,1H2,(H,23,24).
What are the key properties of 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide?
2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide has a molecular weight of 333.82 g/mol, XLogP of 5.65, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-chlorophenyl)ethenyl]-N-phenylbenzamide is sourced from PubChem (CID 154711016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).