(2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide

C12H16F2N2O2 — CID 174568268

IUPAC(2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide
SMILESN[C@H](COC(F)F)C(=O)NCCc1ccccc1
InChIInChI=1S/C12H16F2N2O2/c13-12(14)18-8-10(15)11(17)16-7-6-9-4-2-1-3-5-9/h1-5,10,12H,6-8,15H2,(H,16,17)/t10-/m1/s1
InChIKeyZUFWYIBEFDOWGZ-SNVBAGLBSA-N
MW258.27 g/mol
LogP0.91
Rot. Bonds7

About (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide

(2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide (PubChem CID 174568268) has the molecular formula C12H16F2N2O2 and a molecular weight of 258.27 g/mol. Its IUPAC name is (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide
PubChem CID174568268
Molecular FormulaC12H16F2N2O2
Molecular Weight258.27 g/mol
Exact Mass258.12
IUPAC Name(2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide
SMILESN[C@H](COC(F)F)C(=O)NCCc1ccccc1
InChIInChI=1S/C12H16F2N2O2/c13-12(14)18-8-10(15)11(17)16-7-6-9-4-2-1-3-5-9/h1-5,10,12H,6-8,15H2,(H,16,17)/t10-/m1/s1
InChIKeyZUFWYIBEFDOWGZ-SNVBAGLBSA-N
XLogP0.91
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide 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

2-amino-N-benzyl-3-(difluoromethoxy)propanamide
CID 23649017
(2S)-2-amino-3-phenyl-N-(2-phenylethyl)propanamide;hydrochloride
CID 21308260
2-(N-benzylanilino)-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide
CID 174553710
butyl (3S)-3-amino-4-oxo-4-(2-phenylethylamino)butanoate
CID 165343799
2-amino-N-[2-[4-(difluoromethoxy)phenyl]ethyl]-3-methoxypropanamide
CID 81088412
tert-butyl 3-amino-4-oxo-4-(2-phenylethylamino)butanoate
CID 14514034
2-amino-3-phenyl-N-(2-pyridin-4-ylethyl)propanamide
CID 60904033
(2R)-2-amino-3-(4-chlorophenyl)-N-(2-phenylethyl)propanamide
CID 70832630
(2S)-2-amino-N-[2-(4-methylphenyl)ethyl]-3-phenylpropanamide;hydrochloride
CID 119326873
(2S)-2-amino-3-methyl-N-(2-phenylethyl)pentanamide;hydrochloride
CID 67640844
2-amino-N-[2-(2-hydroxyphenyl)ethyl]-3-methoxypropanamide;hydrochloride
CID 120986590
benzyl (2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(difluoromethoxy)propanoyl]amino]-3-(difluoromethoxy)propanoyl]amino]-4-methylpentanoate
CID 118288421

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide?
The IUPAC name of (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide (CID 174568268) is (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide.
What is the SMILES notation for (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide?
The canonical SMILES for (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide is N[C@H](COC(F)F)C(=O)NCCc1ccccc1.
What is the InChIKey of (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide?
The InChIKey is ZUFWYIBEFDOWGZ-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H16F2N2O2/c13-12(14)18-8-10(15)11(17)16-7-6-9-4-2-1-3-5-9/h1-5,10,12H,6-8,15H2,(H,16,17)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide?
(2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide has a molecular weight of 258.27 g/mol, XLogP of 0.91, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-(difluoromethoxy)-N-(2-phenylethyl)propanamide is sourced from PubChem (CID 174568268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).