N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide

C19H24N2O — CID 54812168

IUPACN-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide
SMILESCc1cc(C)c(NCC(=O)NC(C)c2ccccc2)c(C)c1
InChIInChI=1S/C19H24N2O/c1-13-10-14(2)19(15(3)11-13)20-12-18(22)21-16(4)17-8-6-5-7-9-17/h5-11,16,20H,12H2,1-4H3,(H,21,22)
InChIKeyVOHVBWZJJKJAOI-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.90
Rot. Bonds5

About N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide

N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide (PubChem CID 54812168) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide.

Molecular Properties

Compound NameN-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide
PubChem CID54812168
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC NameN-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide
SMILESCc1cc(C)c(NCC(=O)NC(C)c2ccccc2)c(C)c1
InChIInChI=1S/C19H24N2O/c1-13-10-14(2)19(15(3)11-13)20-12-18(22)21-16(4)17-8-6-5-7-9-17/h5-11,16,20H,12H2,1-4H3,(H,21,22)
InChIKeyVOHVBWZJJKJAOI-UHFFFAOYSA-N
XLogP3.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-phenylethyl)-3-[[2-(2,4,6-trimethylanilino)acetyl]amino]benzamide
CID 54811860
2-(4-methylanilino)-N-(1-phenylethyl)acetamide
CID 54814142
2-anilino-N-(1-phenylethyl)acetamide
CID 54810260
2-(2,6-dichloroanilino)-N-(1-phenylethyl)acetamide
CID 108997357
2-(2,4-dimethylphenyl)sulfanyl-N-(1-phenylethyl)acetamide
CID 6915473
2-(2,5-dimethyl-3-methylsulfonylanilino)-N-(1-phenylethyl)acetamide
CID 22303955
2-(2,3-dimethylanilino)-N-[(1S)-1-phenylethyl]acetamide
CID 9080783
N-[(1R)-1-phenylethyl]-2-[[(1R)-1-phenylethyl]amino]acetamide
CID 7046108
2-(2,5-dimethylphenyl)-N-(1-phenylethyl)acetamide
CID 43905087
2-(2-methylphenyl)sulfanyl-N-[(1R)-1-phenylethyl]acetamide
CID 9330230
2-(2-methylphenyl)sulfanyl-N-[(1S)-1-phenylethyl]acetamide
CID 9330226
2-(4-chloroanilino)-N-[(1S)-1-phenylethyl]acetamide
CID 9098999

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide?
The IUPAC name of N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide (CID 54812168) is N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide.
What is the SMILES notation for N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide?
The canonical SMILES for N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide is Cc1cc(C)c(NCC(=O)NC(C)c2ccccc2)c(C)c1.
What is the InChIKey of N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide?
The InChIKey is VOHVBWZJJKJAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-13-10-14(2)19(15(3)11-13)20-12-18(22)21-16(4)17-8-6-5-7-9-17/h5-11,16,20H,12H2,1-4H3,(H,21,22).
What are the key properties of N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide?
N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide has a molecular weight of 296.41 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylethyl)-2-(2,4,6-trimethylanilino)acetamide is sourced from PubChem (CID 54812168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).