(2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide

C10H14N2O2 — CID 11424108

IUPAC(2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide
SMILESC[C@@](N)(C(N)=O)[C@@H](O)c1ccccc1
InChIInChI=1S/C10H14N2O2/c1-10(12,9(11)14)8(13)7-5-3-2-4-6-7/h2-6,8,13H,12H2,1H3,(H2,11,14)/t8-,10-/m0/s1
InChIKeyRVOQHKRTVITDSA-WPRPVWTQSA-N
MW194.23 g/mol
LogP-0.08
Rot. Bonds3

About (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide

(2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide (PubChem CID 11424108) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide.

Molecular Properties

Compound Name(2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide
PubChem CID11424108
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name(2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide
SMILESC[C@@](N)(C(N)=O)[C@@H](O)c1ccccc1
InChIInChI=1S/C10H14N2O2/c1-10(12,9(11)14)8(13)7-5-3-2-4-6-7/h2-6,8,13H,12H2,1H3,(H2,11,14)/t8-,10-/m0/s1
InChIKeyRVOQHKRTVITDSA-WPRPVWTQSA-N
XLogP-0.08
TPSA89.34 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-2-amino-2-methyl-1-phenylpropan-1-ol
CID 38988546
(3-hydroxy-2,2-dimethyl-3-phenylpropyl) carbamate
CID 4639380
(1R,3R)-2,2-dimethyl-1,3-diphenylpropane-1,3-diol
CID 100943216
3-hydroxy-2-methyl-2-(methylamino)-3-phenylpropanoic acid
CID 555334
3,4-dihydroxy-3-methyl-4-phenylbutan-2-one
CID 15758929
(2R,3R)-2,3-diamino-2-methyl-3-phenylpropanoic acid
CID 24999684
1-amino-2-phenylethane-1,1,2-triol
CID 69451369
2,2-bis(1-phenylethyl)propanediamide
CID 118221756
2-benzhydrylsulfanyl-2-methylpropanamide
CID 15225702
(2R,3R)-2,3-difluoro-2-methyl-3-phenylpropanamide
CID 155931604
benzyl 3-hydroxy-2,2-dimethyl-3-phenylpropanoate
CID 101128345
(1R,2S)-2,3,3-trimethyl-1-phenylbutane-1,2-diol
CID 10774737

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide?
The IUPAC name of (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide (CID 11424108) is (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide.
What is the SMILES notation for (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide?
The canonical SMILES for (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide is C[C@@](N)(C(N)=O)[C@@H](O)c1ccccc1.
What is the InChIKey of (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide?
The InChIKey is RVOQHKRTVITDSA-WPRPVWTQSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-10(12,9(11)14)8(13)7-5-3-2-4-6-7/h2-6,8,13H,12H2,1H3,(H2,11,14)/t8-,10-/m0/s1.
What are the key properties of (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide?
(2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide has a molecular weight of 194.23 g/mol, XLogP of -0.08, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2-amino-3-hydroxy-2-methyl-3-phenylpropanamide is sourced from PubChem (CID 11424108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).