(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide

C17H20N2O — CID 81357033

IUPAC(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
SMILESCc1ccc([C@@H](C)NC(=O)[C@H](N)c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-12-8-10-14(11-9-12)13(2)19-17(20)16(18)15-6-4-3-5-7-15/h3-11,13,16H,18H2,1-2H3,(H,19,20)/t13-,16-/m1/s1
InChIKeyHBNKKTAQQSBZIS-CZUORRHYSA-N
MW268.36 g/mol
LogP2.87
Rot. Bonds4

About (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide

(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide (PubChem CID 81357033) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
PubChem CID81357033
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide
SMILESCc1ccc([C@@H](C)NC(=O)[C@H](N)c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-12-8-10-14(11-9-12)13(2)19-17(20)16(18)15-6-4-3-5-7-15/h3-11,13,16H,18H2,1-2H3,(H,19,20)/t13-,16-/m1/s1
InChIKeyHBNKKTAQQSBZIS-CZUORRHYSA-N
XLogP2.87
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-phenyl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide
CID 119269403
2-amino-N-[1-(3,5-dimethylphenyl)ethyl]-2-phenylacetamide;hydrochloride
CID 119320621
2-amino-N-[(1S)-1-(4-bromophenyl)ethyl]-2-phenylacetamide
CID 81359115
(2S)-2-amino-N-[1-(4-chlorophenyl)ethyl]-2-phenylacetamide
CID 104897669
(2S)-2-amino-N-[1-(4-methylphenyl)ethyl]propanamide
CID 61147129
2-amino-2-(4-methylphenyl)-N-[1-(4-methylsulfonylphenyl)ethyl]acetamide;hydrochloride
CID 120666863
2-amino-N-[(1R)-1-(2-fluorophenyl)ethyl]-2-(4-methylphenyl)acetamide
CID 106312576
2-amino-N-[1-[4-(dimethylsulfamoyl)phenyl]ethyl]-2-(4-methylphenyl)acetamide
CID 120667680
2-amino-N-(4-hydroxy-4-phenylbutan-2-yl)-2-(4-methylphenyl)acetamide;hydrochloride
CID 120668952
2-amino-2-(4-methylphenyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
CID 120666705
2-amino-N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-(4-methylphenyl)acetamide
CID 120667280
(2S)-2-amino-N-[(1R)-1-(3-bromophenyl)ethyl]-2-phenylacetamide
CID 104898206

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide?
The IUPAC name of (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide (CID 81357033) is (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide.
What is the SMILES notation for (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide?
The canonical SMILES for (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide is Cc1ccc([C@@H](C)NC(=O)[C@H](N)c2ccccc2)cc1.
What is the InChIKey of (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide?
The InChIKey is HBNKKTAQQSBZIS-CZUORRHYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12-8-10-14(11-9-12)13(2)19-17(20)16(18)15-6-4-3-5-7-15/h3-11,13,16H,18H2,1-2H3,(H,19,20)/t13-,16-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide?
(2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide has a molecular weight of 268.36 g/mol, XLogP of 2.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(1R)-1-(4-methylphenyl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 81357033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).