N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide

C20H26ClNOSi — CID 142636529

IUPACN-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1C(C)C[Si](C)(C)C
InChIInChI=1S/C20H26ClNOSi/c1-14-6-7-16(12-19(14)15(2)13-24(3,4)5)20(23)22-18-10-8-17(21)9-11-18/h6-12,15H,13H2,1-5H3,(H,22,23)
InChIKeyVPSBMTOPCYWBDD-UHFFFAOYSA-N
MW359.97 g/mol
LogP6.34
Rot. Bonds5

About N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide

N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide (PubChem CID 142636529) has the molecular formula C20H26ClNOSi and a molecular weight of 359.97 g/mol. Its IUPAC name is N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide
PubChem CID142636529
Molecular FormulaC20H26ClNOSi
Molecular Weight359.97 g/mol
Exact Mass359.15
IUPAC NameN-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide
SMILESCc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1C(C)C[Si](C)(C)C
InChIInChI=1S/C20H26ClNOSi/c1-14-6-7-16(12-19(14)15(2)13-24(3,4)5)20(23)22-18-10-8-17(21)9-11-18/h6-12,15H,13H2,1-5H3,(H,22,23)
InChIKeyVPSBMTOPCYWBDD-UHFFFAOYSA-N
XLogP6.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.97
LogP ≤ 56.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chlorophenyl)-4-[2-(dimethylamino)ethylamino]-3-methylbenzamide
CID 175893681
N-(4-chlorophenyl)-4-methyl-3-nitrobenzamide
CID 711327
3-[(4-chlorophenyl)sulfamoyl]-4-methyl-N-phenylbenzamide
CID 3340869
4-chloro-N-(4-chlorophenyl)-3-[(3,4-dimethylphenyl)sulfamoyl]benzamide
CID 126388299
4-[[3-[(4-chlorophenyl)sulfamoyl]-4-methylbenzoyl]amino]benzoic acid
CID 1144112
4-[(3-chloro-4-methylbenzoyl)amino]benzoic acid
CID 28914625
3-chloro-N-(4-chlorophenyl)-4-ethoxybenzamide
CID 876518
3,4-dichloro-N-(4-methyl-3-methylsulfanylphenyl)benzamide
CID 173164167
3,4-dichloro-N-(3,4-dimethylphenyl)benzamide
CID 677956
N-[4-(hydroxymethyl)phenyl]-3,4-dimethylbenzamide
CID 64793175
4-chloro-N-[4-[(4-chlorobenzoyl)amino]-3-methylphenyl]benzamide
CID 27042156
3,4-dimethyl-N-[4-(2-methylpropanoylamino)phenyl]benzamide
CID 893199

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide?
The IUPAC name of N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide (CID 142636529) is N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide.
What is the SMILES notation for N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide?
The canonical SMILES for N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide is Cc1ccc(C(=O)Nc2ccc(Cl)cc2)cc1C(C)C[Si](C)(C)C.
What is the InChIKey of N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide?
The InChIKey is VPSBMTOPCYWBDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26ClNOSi/c1-14-6-7-16(12-19(14)15(2)13-24(3,4)5)20(23)22-18-10-8-17(21)9-11-18/h6-12,15H,13H2,1-5H3,(H,22,23).
What are the key properties of N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide?
N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide has a molecular weight of 359.97 g/mol, XLogP of 6.34, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-4-methyl-3-(1-trimethylsilylpropan-2-yl)benzamide is sourced from PubChem (CID 142636529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).