(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide

C18H22N2O — CID 104897382

IUPAC(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide
SMILESCc1ccccc1CC(C)NC(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C18H22N2O/c1-13-8-6-7-11-16(13)12-14(2)20-18(21)17(19)15-9-4-3-5-10-15/h3-11,14,17H,12,19H2,1-2H3,(H,20,21)/t14?,17-/m0/s1
InChIKeyOHUCXYRMTCWZGT-JRZJBTRGSA-N
MW282.39 g/mol
LogP2.74
Rot. Bonds5

About (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide

(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide (PubChem CID 104897382) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide.

Molecular Properties

Compound Name(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide
PubChem CID104897382
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide
SMILESCc1ccccc1CC(C)NC(=O)[C@@H](N)c1ccccc1
InChIInChI=1S/C18H22N2O/c1-13-8-6-7-11-16(13)12-14(2)20-18(21)17(19)15-9-4-3-5-10-15/h3-11,14,17H,12,19H2,1-2H3,(H,20,21)/t14?,17-/m0/s1
InChIKeyOHUCXYRMTCWZGT-JRZJBTRGSA-N
XLogP2.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide 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-amino-N-[(2R)-1-hydroxypropan-2-yl]-2-phenylacetamide
CID 107218501
(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]butanamide;hydrochloride
CID 119297318
2-amino-N-(5-methylhexan-2-yl)-2-phenylacetamide
CID 43579340
(2S)-2-amino-N-pentan-2-yl-2-phenylacetamide
CID 104897097
N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 541803
1-(2-hydroxy-1-phenylethyl)-3-[1-(2-methylphenyl)propan-2-yl]urea
CID 110901372
2-amino-2-phenyl-N-(4-phenylbutan-2-yl)acetamide
CID 61254237
(2S)-2-amino-N-(4-hydroxypentan-2-yl)-2-phenylacetamide
CID 104898348
2-bromo-3-methyl-N-[1-(2-methylphenyl)propan-2-yl]butanamide
CID 54867370
2-bromo-N-[1-(2-methylphenyl)propan-2-yl]butanamide
CID 62854671
5-[(2-amino-2-phenylacetyl)amino]hexanoic acid
CID 82845613
5-[[(2R)-2-amino-2-phenylacetyl]amino]hexanoic acid
CID 82847398

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide?
The IUPAC name of (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide (CID 104897382) is (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide.
What is the SMILES notation for (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide?
The canonical SMILES for (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide is Cc1ccccc1CC(C)NC(=O)[C@@H](N)c1ccccc1.
What is the InChIKey of (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide?
The InChIKey is OHUCXYRMTCWZGT-JRZJBTRGSA-N. The full InChI is InChI=1S/C18H22N2O/c1-13-8-6-7-11-16(13)12-14(2)20-18(21)17(19)15-9-4-3-5-10-15/h3-11,14,17H,12,19H2,1-2H3,(H,20,21)/t14?,17-/m0/s1.
What are the key properties of (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide?
(2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide has a molecular weight of 282.39 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-[1-(2-methylphenyl)propan-2-yl]-2-phenylacetamide is sourced from PubChem (CID 104897382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).