2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide

C25H23NO2 — CID 159369653

IUPAC2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide
SMILESC/C=C\c1cccc(CC(=O)c2ccccc2NC(=O)c2ccccc2C)c1
InChIInChI=1S/C25H23NO2/c1-3-9-19-11-8-12-20(16-19)17-24(27)22-14-6-7-15-23(22)26-25(28)21-13-5-4-10-18(21)2/h3-16H,17H2,1-2H3,(H,26,28)/b9-3-
InChIKeyLJOSJNWTPFMBKA-OQFOIZHKSA-N
MW369.46 g/mol
LogP5.71
Rot. Bonds6

About 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide

2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide (PubChem CID 159369653) has the molecular formula C25H23NO2 and a molecular weight of 369.46 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide
PubChem CID159369653
Molecular FormulaC25H23NO2
Molecular Weight369.46 g/mol
Exact Mass369.17
IUPAC Name2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide
SMILESC/C=C\c1cccc(CC(=O)c2ccccc2NC(=O)c2ccccc2C)c1
InChIInChI=1S/C25H23NO2/c1-3-9-19-11-8-12-20(16-19)17-24(27)22-14-6-7-15-23(22)26-25(28)21-13-5-4-10-18(21)2/h3-16H,17H2,1-2H3,(H,26,28)/b9-3-
InChIKeyLJOSJNWTPFMBKA-OQFOIZHKSA-N
XLogP5.71
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.46
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-[2-[2-(3-thiophen-2-ylphenyl)acetyl]phenyl]benzamide
CID 157352510
2-ethylsulfanyl-N-[2-[2-(3-methylphenyl)acetyl]phenyl]benzamide
CID 158896086
N-[2-[2-(3-methylphenyl)acetyl]phenyl]-4-nitrobenzamide
CID 158380804
2-(3-chlorophenyl)-1-(2-methylphenyl)ethanone
CID 60799246
(E)-3-[4-chloro-3-[(2-methylbenzoyl)amino]phenyl]prop-2-enoic acid
CID 91688659
2-(3,5-dimethylphenyl)-1-(2-methylphenyl)ethanone
CID 54911077
2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4945880
2-iodo-N-[2-[2-[3-(trifluoromethylsulfonyl)phenyl]acetyl]phenyl]benzamide
CID 149040936
2,6-dimethoxy-N-[2-[2-[3-(trifluoromethyl)phenyl]acetyl]phenyl]benzamide
CID 162047234
N-[2-[[(3-methoxyphenyl)methylideneamino]carbamoyl]phenyl]-2-methylbenzamide
CID 1034803
1-(2-amino-3-methylphenyl)-2-phenylethanone
CID 68579137
3-hydroxy-2-methyl-N-(2-methylphenyl)benzamide
CID 82786919

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide?
The IUPAC name of 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide (CID 159369653) is 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide.
What is the SMILES notation for 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide?
The canonical SMILES for 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide is C/C=C\c1cccc(CC(=O)c2ccccc2NC(=O)c2ccccc2C)c1.
What is the InChIKey of 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide?
The InChIKey is LJOSJNWTPFMBKA-OQFOIZHKSA-N. The full InChI is InChI=1S/C25H23NO2/c1-3-9-19-11-8-12-20(16-19)17-24(27)22-14-6-7-15-23(22)26-25(28)21-13-5-4-10-18(21)2/h3-16H,17H2,1-2H3,(H,26,28)/b9-3-.
What are the key properties of 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide?
2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide has a molecular weight of 369.46 g/mol, XLogP of 5.71, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-[3-[(Z)-prop-1-enyl]phenyl]acetyl]phenyl]benzamide is sourced from PubChem (CID 159369653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).