(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid

C16H17NO3 — CID 7345316

IUPAC(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid
SMILESC[C@](N)(C(=O)O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C16H17NO3/c1-16(17,15(18)19)13-8-5-9-14(10-13)20-11-12-6-3-2-4-7-12/h2-10H,11,17H2,1H3,(H,18,19)/t16-/m1/s1
InChIKeyKVLINBHOMPFTRV-MRXNPFEDSA-N
MW271.32 g/mol
LogP2.52
Rot. Bonds5

About (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid

(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid (PubChem CID 7345316) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid.

Molecular Properties

Compound Name(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid
PubChem CID7345316
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid
SMILESC[C@](N)(C(=O)O)c1cccc(OCc2ccccc2)c1
InChIInChI=1S/C16H17NO3/c1-16(17,15(18)19)13-8-5-9-14(10-13)20-11-12-6-3-2-4-7-12/h2-10H,11,17H2,1H3,(H,18,19)/t16-/m1/s1
InChIKeyKVLINBHOMPFTRV-MRXNPFEDSA-N
XLogP2.52
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-phenylmethoxyphenyl)propan-2-ol
CID 13368032
2-amino-2-(3-methoxyphenyl)propanoic acid
CID 4018837
(2S)-2-amino-2-[3-(carboxymethyl)phenyl]propanoic acid
CID 6604768
6-methyl-6-(3-phenylmethoxyphenyl)hepta-2,4-dienoic acid
CID 72530435
N-[2-methyl-2-(3-phenylmethoxyphenyl)propyl]propanamide
CID 118609735
(2S)-2-amino-2-methyl-3-(4-phenylmethoxyphenyl)propanoic acid
CID 14019806
benzyl 2,2-dimethyl-3-(3-phenylmethoxyphenyl)propanoate
CID 138549970
methyl (2R)-2,4-dimethyl-2-(3-phenylmethoxyphenyl)pent-4-enoate
CID 129390639
1-tert-butyl-3-[(4-phenylphenyl)methoxy]benzene
CID 59734480
(2S)-2-hydroxy-2-(4-phenylmethoxyphenyl)propanoic acid
CID 131871320
2-hydroxy-2-phenyl-2-(4-phenylmethoxyphenyl)acetamide
CID 139613624
2,2-dimethyl-1-(4-phenylmethoxyphenyl)propan-1-one
CID 14125672

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid?
The IUPAC name of (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid (CID 7345316) is (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid.
What is the SMILES notation for (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid?
The canonical SMILES for (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid is C[C@](N)(C(=O)O)c1cccc(OCc2ccccc2)c1.
What is the InChIKey of (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid?
The InChIKey is KVLINBHOMPFTRV-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H17NO3/c1-16(17,15(18)19)13-8-5-9-14(10-13)20-11-12-6-3-2-4-7-12/h2-10H,11,17H2,1H3,(H,18,19)/t16-/m1/s1.
What are the key properties of (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid?
(2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid has a molecular weight of 271.32 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-2-(3-phenylmethoxyphenyl)propanoic acid is sourced from PubChem (CID 7345316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).