(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide

C18H22N2O — CID 78973061

IUPAC(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide
SMILESC[C@@H](N)C(=O)N(CCc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H22N2O/c1-15(19)18(21)20(14-17-10-6-3-7-11-17)13-12-16-8-4-2-5-9-16/h2-11,15H,12-14,19H2,1H3/t15-/m1/s1
InChIKeySWXHFTSROWXVLB-OAHLLOKOSA-N
MW282.39 g/mol
LogP2.61
Rot. Bonds6

About (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide

(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide (PubChem CID 78973061) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide
PubChem CID78973061
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide
SMILESC[C@@H](N)C(=O)N(CCc1ccccc1)Cc1ccccc1
InChIInChI=1S/C18H22N2O/c1-15(19)18(21)20(14-17-10-6-3-7-11-17)13-12-16-8-4-2-5-9-16/h2-11,15H,12-14,19H2,1H3/t15-/m1/s1
InChIKeySWXHFTSROWXVLB-OAHLLOKOSA-N
XLogP2.61
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-benzyl-N-(2-phenylethyl)pentanamide
CID 119264050
3-amino-N-benzyl-N-(2-phenylethyl)butanamide
CID 119675960
(2S)-2-amino-N-(2-phenylethyl)-N-prop-2-enylpropanamide;hydrochloride
CID 119305394
(2R)-2-amino-N-methyl-N-(2-phenylethyl)propanamide
CID 78973247
(2S)-2-amino-N-benzyl-N-[2-(2-methoxyethoxy)ethyl]propanamide;hydrochloride
CID 119341269
(2S)-2-amino-N-benzyl-N-(cyclobutylmethyl)propanamide;hydrochloride
CID 119305505
(2R)-2-amino-N-benzyl-N-phenylpropanamide
CID 54996061
N-benzyl-3-phenyl-N-(2-phenylethyl)propanamide
CID 42775856
4-amino-N-benzyl-N-[2-(4-methoxyphenyl)ethyl]pentanamide
CID 120562136
N-(3-aminopropyl)-N-benzyl-2,3-dimethylbutanamide
CID 107365679
(2S,3S)-2-amino-N-benzyl-N-(2-hydroxyethyl)-3-methylpentanamide
CID 61164685
[4-(2-hydroxyethyl)phenyl]methyl-(2-phenylethyl)carbamic acid
CID 143540214

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide?
The IUPAC name of (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide (CID 78973061) is (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide is C[C@@H](N)C(=O)N(CCc1ccccc1)Cc1ccccc1.
What is the InChIKey of (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide?
The InChIKey is SWXHFTSROWXVLB-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H22N2O/c1-15(19)18(21)20(14-17-10-6-3-7-11-17)13-12-16-8-4-2-5-9-16/h2-11,15H,12-14,19H2,1H3/t15-/m1/s1.
What are the key properties of (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide?
(2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide has a molecular weight of 282.39 g/mol, XLogP of 2.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-benzyl-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 78973061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).