(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide

C15H14F2N2O2 — CID 104904585

IUPAC(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
SMILESN[C@H](Cc1ccc(O)cc1)C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H14F2N2O2/c16-12-6-3-10(8-13(12)17)19-15(21)14(18)7-9-1-4-11(20)5-2-9/h1-6,8,14,20H,7,18H2,(H,19,21)/t14-/m1/s1
InChIKeyZUYGNTDFVGXQPY-CQSZACIVSA-N
MW292.29 g/mol
LogP2.18
Rot. Bonds4

About (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide

(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide (PubChem CID 104904585) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
PubChem CID104904585
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
SMILESN[C@H](Cc1ccc(O)cc1)C(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C15H14F2N2O2/c16-12-6-3-10(8-13(12)17)19-15(21)14(18)7-9-1-4-11(20)5-2-9/h1-6,8,14,20H,7,18H2,(H,19,21)/t14-/m1/s1
InChIKeyZUYGNTDFVGXQPY-CQSZACIVSA-N
XLogP2.18
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(4-chloro-3-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76887225
2-amino-N-(4-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76891904
2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76891970
(2R)-2-amino-N-(4-hydroxy-3-methylphenyl)-3-(4-hydroxyphenyl)propanamide
CID 104905420
(2R)-2-amino-3-(4-hydroxyphenyl)-N-(4-methylsulfanylphenyl)propanamide
CID 104904568
(2S)-2-amino-N-(5-bromo-2-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 61154211
2-amino-N-(2-fluoro-5-methylphenyl)-3-(4-hydroxyphenyl)propanamide
CID 76892554
(2R)-2-amino-N-[3-(hydroxymethyl)phenyl]-3-(4-hydroxyphenyl)propanamide
CID 104904818
(2R)-2-amino-N-(4-fluoro-3-methylphenyl)-3-phenylpropanamide
CID 78917568
(2S)-2-amino-3-(4-hydroxyphenyl)-N-(4-nitrophenyl)propanamide
CID 22847699
(2S)-2-amino-N-(3-ethynylphenyl)-3-(4-hydroxyphenyl)propanamide
CID 61148013
(2R)-2-amino-N-(2-fluoro-6-methylphenyl)-3-(4-hydroxyphenyl)propanamide
CID 104905619

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
The IUPAC name of (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide (CID 104904585) is (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide is N[C@H](Cc1ccc(O)cc1)C(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
The InChIKey is ZUYGNTDFVGXQPY-CQSZACIVSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c16-12-6-3-10(8-13(12)17)19-15(21)14(18)7-9-1-4-11(20)5-2-9/h1-6,8,14,20H,7,18H2,(H,19,21)/t14-/m1/s1.
What are the key properties of (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide has a molecular weight of 292.29 g/mol, XLogP of 2.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide is sourced from PubChem (CID 104904585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).