(2R)-2-amino-2-methyl-3-phenylpropanoic acid

C10H13NO2 — CID 7023409

IUPAC(2R)-2-amino-2-methyl-3-phenylpropanoic acid
SMILESC[C@@](N)(Cc1ccccc1)C(=O)O
InChIInChI=1S/C10H13NO2/c1-10(11,9(12)13)7-8-5-3-2-4-6-8/h2-6H,7,11H2,1H3,(H,12,13)/t10-/m1/s1
InChIKeyHYOWVAAEQCNGLE-SNVBAGLBSA-N
MW179.22 g/mol
LogP1.03
Rot. Bonds3

About (2R)-2-amino-2-methyl-3-phenylpropanoic acid

(2R)-2-amino-2-methyl-3-phenylpropanoic acid (PubChem CID 7023409) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is (2R)-2-amino-2-methyl-3-phenylpropanoic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-methyl-3-phenylpropanoic acid
PubChem CID7023409
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name(2R)-2-amino-2-methyl-3-phenylpropanoic acid
SMILESC[C@@](N)(Cc1ccccc1)C(=O)O
InChIInChI=1S/C10H13NO2/c1-10(11,9(12)13)7-8-5-3-2-4-6-8/h2-6H,7,11H2,1H3,(H,12,13)/t10-/m1/s1
InChIKeyHYOWVAAEQCNGLE-SNVBAGLBSA-N
XLogP1.03
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-2,4,4-trimethyl-1-phenylpentan-3-one
CID 177194439
(2S)-2-amino-2-methyl-3-(4-phenylmethoxyphenyl)propanoic acid
CID 14019806
2-amino-2-methyl-3-(4-sulfanylphenyl)propanoic acid
CID 123948298
2-amino-3-(3-hydroxyphenyl)-2-methylpropanoic acid;hydrate
CID 2729001
(2R)-2-[[(2S)-2-amino-2-methyl-3-phenylpropanoyl]amino]-2-methyl-3-phenylpropanoic acid
CID 134918907
(2R)-2-amino-3-(3,4-diaminophenyl)-2-methylpropanoic acid
CID 70564391
(2S)-2-amino-2-methyl-3-phenylmethoxypropanoic acid
CID 121267296
2-amino-3-(2-bromophenyl)-2-methylpropanoic acid
CID 53401931
(2S)-2-amino-2-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]phenyl]propanoic acid
CID 10803655
(2R)-2-amino-2-chloro-3-phenylpropanoic acid
CID 21116120
(2R)-2-amino-2-fluoro-3-phenylpropanoic acid
CID 54456970
2-methyl-3-phenyl-2-sulfanylpropanoic acid
CID 19690137

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-methyl-3-phenylpropanoic acid?
The IUPAC name of (2R)-2-amino-2-methyl-3-phenylpropanoic acid (CID 7023409) is (2R)-2-amino-2-methyl-3-phenylpropanoic acid.
What is the SMILES notation for (2R)-2-amino-2-methyl-3-phenylpropanoic acid?
The canonical SMILES for (2R)-2-amino-2-methyl-3-phenylpropanoic acid is C[C@@](N)(Cc1ccccc1)C(=O)O.
What is the InChIKey of (2R)-2-amino-2-methyl-3-phenylpropanoic acid?
The InChIKey is HYOWVAAEQCNGLE-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H13NO2/c1-10(11,9(12)13)7-8-5-3-2-4-6-8/h2-6H,7,11H2,1H3,(H,12,13)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-2-methyl-3-phenylpropanoic acid?
(2R)-2-amino-2-methyl-3-phenylpropanoic acid has a molecular weight of 179.22 g/mol, XLogP of 1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-methyl-3-phenylpropanoic acid is sourced from PubChem (CID 7023409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).