N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide

C22H19NO — CID 174311463

IUPACN-(4-methylphenyl)-N-(2-phenylethenyl)benzamide
SMILESCc1ccc(N(C=Cc2ccccc2)C(=O)c2ccccc2)cc1
InChIInChI=1S/C22H19NO/c1-18-12-14-21(15-13-18)23(17-16-19-8-4-2-5-9-19)22(24)20-10-6-3-7-11-20/h2-17H,1H3
InChIKeyKPNIJKFHBNZSBA-UHFFFAOYSA-N
MW313.40 g/mol
LogP5.31
Rot. Bonds4

About N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide

N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide (PubChem CID 174311463) has the molecular formula C22H19NO and a molecular weight of 313.40 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-(2-phenylethenyl)benzamide
PubChem CID174311463
Molecular FormulaC22H19NO
Molecular Weight313.40 g/mol
Exact Mass313.15
IUPAC NameN-(4-methylphenyl)-N-(2-phenylethenyl)benzamide
SMILESCc1ccc(N(C=Cc2ccccc2)C(=O)c2ccccc2)cc1
InChIInChI=1S/C22H19NO/c1-18-12-14-21(15-13-18)23(17-16-19-8-4-2-5-9-19)22(24)20-10-6-3-7-11-20/h2-17H,1H3
InChIKeyKPNIJKFHBNZSBA-UHFFFAOYSA-N
XLogP5.31
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500313.40
LogP ≤ 55.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide?
The IUPAC name of N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide (CID 174311463) is N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide.
What is the SMILES notation for N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide?
The canonical SMILES for N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide is Cc1ccc(N(C=Cc2ccccc2)C(=O)c2ccccc2)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide?
The InChIKey is KPNIJKFHBNZSBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO/c1-18-12-14-21(15-13-18)23(17-16-19-8-4-2-5-9-19)22(24)20-10-6-3-7-11-20/h2-17H,1H3.
What are the key properties of N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide?
N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide has a molecular weight of 313.40 g/mol, XLogP of 5.31, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-(2-phenylethenyl)benzamide is sourced from PubChem (CID 174311463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).