N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide

C18H22N2O2 — CID 110012993

IUPACN-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide
SMILESCc1cccc(C)c1NC(=O)CNC(CO)c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-13-7-6-8-14(2)18(13)20-17(22)11-19-16(12-21)15-9-4-3-5-10-15/h3-10,16,19,21H,11-12H2,1-2H3,(H,20,22)
InChIKeyWWSOQNVTARJYNZ-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.57
Rot. Bonds6

About N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide

N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide (PubChem CID 110012993) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide
PubChem CID110012993
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide
SMILESCc1cccc(C)c1NC(=O)CNC(CO)c1ccccc1
InChIInChI=1S/C18H22N2O2/c1-13-7-6-8-14(2)18(13)20-17(22)11-19-16(12-21)15-9-4-3-5-10-15/h3-10,16,19,21H,11-12H2,1-2H3,(H,20,22)
InChIKeyWWSOQNVTARJYNZ-UHFFFAOYSA-N
XLogP2.57
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]propanoic acid
CID 43467206
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392402
N-[(1S)-3-(2,6-dimethylanilino)-3-oxo-1-phenylpropyl]benzamide
CID 51870095
2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-3-methylbutanoic acid
CID 43468395
2-[(2-hydroxy-1-phenylethyl)amino]-N-(3-methylbutyl)acetamide
CID 63183041
N-butyl-2-[(2-hydroxy-1-phenylethyl)amino]acetamide
CID 63182961
2-(butan-2-ylamino)-N-(2,6-dimethylphenyl)acetamide
CID 21430532
(2S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-[[(1S)-3-methyl-1-phenylbutyl]amino]propanamide
CID 8646005
2-(benzhydrylamino)-N-(2-methyl-6-nitrophenyl)acetamide
CID 8545864
2-[[2-(2-ethyl-6-methylanilino)-2-oxoethyl]amino]-2-phenylacetamide
CID 138015522
tert-butyl 2-[[(1R)-2-hydroxy-1-phenylethyl]amino]acetate
CID 15391419
N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-phenylacetamide
CID 7676704

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide (CID 110012993) is N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide is Cc1cccc(C)c1NC(=O)CNC(CO)c1ccccc1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide?
The InChIKey is WWSOQNVTARJYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-13-7-6-8-14(2)18(13)20-17(22)11-19-16(12-21)15-9-4-3-5-10-15/h3-10,16,19,21H,11-12H2,1-2H3,(H,20,22).
What are the key properties of N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide?
N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide has a molecular weight of 298.39 g/mol, XLogP of 2.57, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-[(2-hydroxy-1-phenylethyl)amino]acetamide is sourced from PubChem (CID 110012993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).