N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide

C20H23NO — CID 59270019

IUPACN-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide
SMILESC=Cc1ccc(NC(=O)c2ccc(C(C)(C)CC)cc2)cc1
InChIInChI=1S/C20H23NO/c1-5-15-7-13-18(14-8-15)21-19(22)16-9-11-17(12-10-16)20(3,4)6-2/h5,7-14H,1,6H2,2-4H3,(H,21,22)
InChIKeyKRVBXELRBPZCRN-UHFFFAOYSA-N
MW293.41 g/mol
LogP5.27
Rot. Bonds5

About N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide

N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide (PubChem CID 59270019) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide.

Molecular Properties

Compound NameN-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide
PubChem CID59270019
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC NameN-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide
SMILESC=Cc1ccc(NC(=O)c2ccc(C(C)(C)CC)cc2)cc1
InChIInChI=1S/C20H23NO/c1-5-15-7-13-18(14-8-15)21-19(22)16-9-11-17(12-10-16)20(3,4)6-2/h5,7-14H,1,6H2,2-4H3,(H,21,22)
InChIKeyKRVBXELRBPZCRN-UHFFFAOYSA-N
XLogP5.27
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.41
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-aminophenyl)-4-ethenylbenzamide
CID 13082944
4-(aminomethyl)-N-(4-ethenylphenyl)benzamide
CID 166434633
4-tert-butyl-N-[4-[[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]carbamoyl]phenyl]benzamide
CID 17093395
1,1-dimethyl-3-[4-(2-methylbutan-2-yl)phenyl]urea
CID 121366725
N,N'-bis[4-[(4-tert-butylbenzoyl)amino]phenyl]pentanediamide
CID 17235324
N,N'-bis[4-[(4-tert-butylbenzoyl)amino]phenyl]butanediamide
CID 17235325
N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1,3-dioxoisoindole-5-carboxamide
CID 130284062
N-(4-tert-butylphenyl)-4-(2-methylpropanoylamino)benzamide
CID 39088297
4-(2-methylbutan-2-yl)-N-quinolin-3-ylbenzamide
CID 66815675
4-[(3,4-dihydroxyphenyl)diazenyl]-N-(4-ethenylphenyl)benzamide
CID 137158163
5-methyl-N-[4-(2-methylbutan-2-yl)phenyl]-1,2-oxazole-4-carboxamide
CID 19871639
4-(2-methylbutan-2-ylcarbamoyl)-6-[[4-(2-methylbutan-2-yl)phenyl]carbamoyl]benzene-1,3-dicarboxylic acid
CID 144585610

Frequently Asked Questions

What is the IUPAC name of N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide?
The IUPAC name of N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide (CID 59270019) is N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide.
What is the SMILES notation for N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide?
The canonical SMILES for N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide is C=Cc1ccc(NC(=O)c2ccc(C(C)(C)CC)cc2)cc1.
What is the InChIKey of N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide?
The InChIKey is KRVBXELRBPZCRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-5-15-7-13-18(14-8-15)21-19(22)16-9-11-17(12-10-16)20(3,4)6-2/h5,7-14H,1,6H2,2-4H3,(H,21,22).
What are the key properties of N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide?
N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide has a molecular weight of 293.41 g/mol, XLogP of 5.27, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethenylphenyl)-4-(2-methylbutan-2-yl)benzamide is sourced from PubChem (CID 59270019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).