(2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide

C19H23NO — CID 793462

IUPAC(2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)[C@@H](C)Cc2ccccc2)c(C)c1
InChIInChI=1S/C19H23NO/c1-13-10-14(2)18(15(3)11-13)20-19(21)16(4)12-17-8-6-5-7-9-17/h5-11,16H,12H2,1-4H3,(H,20,21)/t16-/m0/s1
InChIKeyNLBJODFZGCFLBL-INIZCTEOSA-N
MW281.40 g/mol
LogP4.43
Rot. Bonds4

About (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide

(2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide (PubChem CID 793462) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide
PubChem CID793462
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name(2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide
SMILESCc1cc(C)c(NC(=O)[C@@H](C)Cc2ccccc2)c(C)c1
InChIInChI=1S/C19H23NO/c1-13-10-14(2)18(15(3)11-13)20-19(21)16(4)12-17-8-6-5-7-9-17/h5-11,16H,12H2,1-4H3,(H,20,21)/t16-/m0/s1
InChIKeyNLBJODFZGCFLBL-INIZCTEOSA-N
XLogP4.43
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide
CID 41374212
2-[(4-chlorophenyl)sulfonylamino]-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide
CID 3877256
2-anilino-N-(2,4,6-trimethylphenyl)propanamide
CID 78666778
3-phenyl-2-(thiophen-2-ylsulfonylamino)-N-(2,4,6-trimethylphenyl)propanamide
CID 46361165
methyl-[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethyl]-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium
CID 9338626
3-phenyl-2-(2,4,6-trimethylphenyl)propanoic acid
CID 82139246
2-(4-phenylphenyl)-N-(2,4,6-trimethylphenyl)acetamide
CID 8760031
(2S)-N-(4-chlorophenyl)-2-methyl-3-phenylpropanamide
CID 793554
2-[[2-(1,2-diphenylethylamino)-2-oxoethyl]-methylamino]-N-(2,4,6-trimethylphenyl)acetamide
CID 55381874
(2S)-N-(3-chlorophenyl)-2-methyl-3-phenylpropanamide
CID 56610654
[(2S)-1-oxo-1-(2,4,6-trimethylanilino)propan-2-yl] 2-(2-methylphenyl)sulfanylacetate
CID 7229618
N-ethyl-2-methyl-3-phenylpropanamide
CID 58846627

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide?
The IUPAC name of (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide (CID 793462) is (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide.
What is the SMILES notation for (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide?
The canonical SMILES for (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide is Cc1cc(C)c(NC(=O)[C@@H](C)Cc2ccccc2)c(C)c1.
What is the InChIKey of (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide?
The InChIKey is NLBJODFZGCFLBL-INIZCTEOSA-N. The full InChI is InChI=1S/C19H23NO/c1-13-10-14(2)18(15(3)11-13)20-19(21)16(4)12-17-8-6-5-7-9-17/h5-11,16H,12H2,1-4H3,(H,20,21)/t16-/m0/s1.
What are the key properties of (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide?
(2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide has a molecular weight of 281.40 g/mol, XLogP of 4.43, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-3-phenyl-N-(2,4,6-trimethylphenyl)propanamide is sourced from PubChem (CID 793462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).