(2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide

C15H16N2O2 — CID 90046511

IUPAC(2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide
SMILESNC(=O)[C@@H](N)C(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C15H16N2O2/c16-14(15(17)19)13(10-4-2-1-3-5-10)11-6-8-12(18)9-7-11/h1-9,13-14,18H,16H2,(H2,17,19)/t13?,14-/m0/s1
InChIKeyDOYBIPAQZGGCNC-KZUDCZAMSA-N
MW256.31 g/mol
LogP1.34
Rot. Bonds4

About (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide

(2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide (PubChem CID 90046511) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide.

Molecular Properties

Compound Name(2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide
PubChem CID90046511
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name(2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide
SMILESNC(=O)[C@@H](N)C(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C15H16N2O2/c16-14(15(17)19)13(10-4-2-1-3-5-10)11-6-8-12(18)9-7-11/h1-9,13-14,18H,16H2,(H2,17,19)/t13?,14-/m0/s1
InChIKeyDOYBIPAQZGGCNC-KZUDCZAMSA-N
XLogP1.34
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-3,3-diphenylpropanoic acid;carbamic acid
CID 175734272
(2S)-2-amino-3-(6-methoxy-3-pyridinyl)-3-phenylpropanamide
CID 144781663
(2R,3R)-2-amino-3-fluoro-3-phenylpropanamide
CID 13182012
(2R)-2-(4-hydroxyphenyl)propanoic acid;(1S)-1-phenylethanamine
CID 162087543
2-hydroxy-2-phenylacetamide;hydrochloride
CID 67718904
benzene-1,4-diol;carbamic acid
CID 158152403
(4-hydroxyphenyl) 2-amino-3-(2-carbamoyl-5-hydroxyphenyl)-3-phenylpropanoate
CID 175328976
oxamide;phenol
CID 21277500
methyl (2S)-2-[[(4-hydroxyphenyl)-phenylmethyl]amino]propanoate
CID 43723711
2-phenyl-2-sulfanylacetamide
CID 19419425
2-[2-(2-hydroxyphenyl)-1,2-bis(4-hydroxyphenyl)ethyl]phenol
CID 67705842
(1R)-1-amino-3-(4-hydroxyphenyl)-1-phenylpropan-2-one
CID 104891138

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide?
The IUPAC name of (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide (CID 90046511) is (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide.
What is the SMILES notation for (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide?
The canonical SMILES for (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide is NC(=O)[C@@H](N)C(c1ccccc1)c1ccc(O)cc1.
What is the InChIKey of (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide?
The InChIKey is DOYBIPAQZGGCNC-KZUDCZAMSA-N. The full InChI is InChI=1S/C15H16N2O2/c16-14(15(17)19)13(10-4-2-1-3-5-10)11-6-8-12(18)9-7-11/h1-9,13-14,18H,16H2,(H2,17,19)/t13?,14-/m0/s1.
What are the key properties of (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide?
(2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide has a molecular weight of 256.31 g/mol, XLogP of 1.34, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-(4-hydroxyphenyl)-3-phenylpropanamide is sourced from PubChem (CID 90046511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).