(2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid

C15H14FNO3 — CID 166226941

IUPAC(2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid
SMILESO=C(O)[C@H](NCc1ccccc1F)c1ccc(O)cc1
InChIInChI=1S/C15H14FNO3/c16-13-4-2-1-3-11(13)9-17-14(15(19)20)10-5-7-12(18)8-6-10/h1-8,14,17-18H,9H2,(H,19,20)/t14-/m1/s1
InChIKeyKRPUAJBLYLOCDS-CQSZACIVSA-N
MW275.28 g/mol
LogP2.45
Rot. Bonds5

About (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid

(2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid (PubChem CID 166226941) has the molecular formula C15H14FNO3 and a molecular weight of 275.28 g/mol. Its IUPAC name is (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid.

Molecular Properties

Compound Name(2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid
PubChem CID166226941
Molecular FormulaC15H14FNO3
Molecular Weight275.28 g/mol
Exact Mass275.10
IUPAC Name(2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid
SMILESO=C(O)[C@H](NCc1ccccc1F)c1ccc(O)cc1
InChIInChI=1S/C15H14FNO3/c16-13-4-2-1-3-11(13)9-17-14(15(19)20)10-5-7-12(18)8-6-10/h1-8,14,17-18H,9H2,(H,19,20)/t14-/m1/s1
InChIKeyKRPUAJBLYLOCDS-CQSZACIVSA-N
XLogP2.45
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 52.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-2-[(2-fluorophenyl)methylamino]-2-phenylacetamide
CID 33473493
2-[(4-bromo-2-fluorophenyl)methylamino]-2-phenylacetic acid
CID 62110835
2-[(2-ethylphenyl)methylamino]-2-phenylacetic acid
CID 62392789
2-[(3,5-difluoro-4-hydroxyphenyl)methylamino]-2-phenylacetic acid
CID 79883687
2-[(2-fluorophenyl)methylamino]-3-methylbutanoic acid;hydrochloride
CID 163331541
2-(benzylamino)-2-(3,4-difluorophenyl)acetic acid
CID 60992267
2-(2-fluoroethylamino)-2-phenylacetic acid
CID 80695440
2-(2-fluorophenyl)-N-(4-hydroxyphenyl)acetamide
CID 28739611
(2R)-2-[[2-(2-fluorophenyl)acetyl]amino]-2-phenylacetamide
CID 94514859
2-[(2-fluorophenyl)methylamino]hexanoic acid
CID 82364371
2-(4-ethylphenyl)-2-[(2-methoxyphenyl)methylamino]acetic acid
CID 84747421
3-[(2-fluorophenyl)methylamino]-2-methyl-3-oxopropanoic acid
CID 114897168

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid?
The IUPAC name of (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid (CID 166226941) is (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid.
What is the SMILES notation for (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid?
The canonical SMILES for (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid is O=C(O)[C@H](NCc1ccccc1F)c1ccc(O)cc1.
What is the InChIKey of (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid?
The InChIKey is KRPUAJBLYLOCDS-CQSZACIVSA-N. The full InChI is InChI=1S/C15H14FNO3/c16-13-4-2-1-3-11(13)9-17-14(15(19)20)10-5-7-12(18)8-6-10/h1-8,14,17-18H,9H2,(H,19,20)/t14-/m1/s1.
What are the key properties of (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid?
(2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid has a molecular weight of 275.28 g/mol, XLogP of 2.45, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2-fluorophenyl)methylamino]-2-(4-hydroxyphenyl)acetic acid is sourced from PubChem (CID 166226941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).