(2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide

C19H21F3N2O — CID 119294899

IUPAC(2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide
SMILESCC(Cc1ccc(C(F)(F)F)cc1)NC(=O)[C@@H](N)Cc1ccccc1
InChIInChI=1S/C19H21F3N2O/c1-13(11-15-7-9-16(10-8-15)19(20,21)22)24-18(25)17(23)12-14-5-3-2-4-6-14/h2-10,13,17H,11-12,23H2,1H3,(H,24,25)/t13?,17-/m0/s1
InChIKeyULTMBKQZBKORSV-RUINGEJQSA-N
MW350.38 g/mol
LogP3.32
Rot. Bonds6

About (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide

(2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide (PubChem CID 119294899) has the molecular formula C19H21F3N2O and a molecular weight of 350.38 g/mol. Its IUPAC name is (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide.

Molecular Properties

Compound Name(2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide
PubChem CID119294899
Molecular FormulaC19H21F3N2O
Molecular Weight350.38 g/mol
Exact Mass350.16
IUPAC Name(2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide
SMILESCC(Cc1ccc(C(F)(F)F)cc1)NC(=O)[C@@H](N)Cc1ccccc1
InChIInChI=1S/C19H21F3N2O/c1-13(11-15-7-9-16(10-8-15)19(20,21)22)24-18(25)17(23)12-14-5-3-2-4-6-14/h2-10,13,17H,11-12,23H2,1H3,(H,24,25)/t13?,17-/m0/s1
InChIKeyULTMBKQZBKORSV-RUINGEJQSA-N
XLogP3.32
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]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

(2R)-2-amino-N-butan-2-yl-3-phenylpropanamide
CID 78985447
(2S)-2-amino-N-(1-phenylpropan-2-yl)butanamide
CID 79022695
2-amino-2-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide
CID 120589300
2-amino-2-(4-methylphenyl)-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]acetamide
CID 120667536
2-amino-3-phenyl-N-propan-2-ylpropanamide
CID 15926064
(2R)-2-amino-N-(1-phenylpropan-2-yl)propanamide
CID 78923419
2-amino-N-(1-methylsulfinylpropan-2-yl)-3-phenylpropanamide
CID 113486466
4-amino-5-oxo-5-(1-phenylpropan-2-ylamino)pentanoic acid
CID 64890331
(2R)-2-amino-3-methyl-N-(1-phenylpropan-2-yl)butanamide
CID 79012840
(2R)-2-amino-N-pent-4-en-2-yl-3-phenylpropanamide
CID 103797386
(2S)-2-amino-N-(1-cyclopropylpropan-2-yl)-3-phenylpropanamide
CID 78955758
2-amino-N-octan-2-yl-3-phenylpropanamide
CID 43711429

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide?
The IUPAC name of (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide (CID 119294899) is (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide.
What is the SMILES notation for (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide?
The canonical SMILES for (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide is CC(Cc1ccc(C(F)(F)F)cc1)NC(=O)[C@@H](N)Cc1ccccc1.
What is the InChIKey of (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide?
The InChIKey is ULTMBKQZBKORSV-RUINGEJQSA-N. The full InChI is InChI=1S/C19H21F3N2O/c1-13(11-15-7-9-16(10-8-15)19(20,21)22)24-18(25)17(23)12-14-5-3-2-4-6-14/h2-10,13,17H,11-12,23H2,1H3,(H,24,25)/t13?,17-/m0/s1.
What are the key properties of (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide?
(2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide has a molecular weight of 350.38 g/mol, XLogP of 3.32, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-phenyl-N-[1-[4-(trifluoromethyl)phenyl]propan-2-yl]propanamide is sourced from PubChem (CID 119294899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).