(2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide

C14H19F3N2O2 — CID 110027716

IUPAC(2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide
SMILESC[C@H](C(N)=O)N(C)CC(O)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H19F3N2O2/c1-9(13(18)21)19(2)8-12(20)7-10-3-5-11(6-4-10)14(15,16)17/h3-6,9,12,20H,7-8H2,1-2H3,(H2,18,21)/t9-,12?/m1/s1
InChIKeyPNYGOHMPIADUQU-PKEIRNPWSA-N
MW304.31 g/mol
LogP1.41
Rot. Bonds6

About (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide

(2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide (PubChem CID 110027716) has the molecular formula C14H19F3N2O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide.

Molecular Properties

Compound Name(2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide
PubChem CID110027716
Molecular FormulaC14H19F3N2O2
Molecular Weight304.31 g/mol
Exact Mass304.14
IUPAC Name(2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide
SMILESC[C@H](C(N)=O)N(C)CC(O)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C14H19F3N2O2/c1-9(13(18)21)19(2)8-12(20)7-10-3-5-11(6-4-10)14(15,16)17/h3-6,9,12,20H,7-8H2,1-2H3,(H2,18,21)/t9-,12?/m1/s1
InChIKeyPNYGOHMPIADUQU-PKEIRNPWSA-N
XLogP1.41
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]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-bromo-3-[4-(trifluoromethyl)phenyl]propanamide
CID 75480705
3-amino-2-hydroxy-4-[4-(trifluoromethyl)phenyl]butanamide
CID 153385822
1-methoxy-3-[4-(trifluoromethyl)phenyl]propan-2-ol
CID 62606366
5,5,5-trifluoro-1-[4-(trifluoromethyl)phenyl]pentan-2-ol
CID 79953429
4,6,6-trimethyl-1-[4-(trifluoromethyl)phenyl]heptan-2-ol
CID 115791046
1-(2-methyltellanylpropyl)-4-(trifluoromethyl)benzene
CID 23075300
4-[[[(2S)-1-amino-1-oxopropan-2-yl]-methylamino]methyl]-N-(2,2,2-trifluoroethyl)benzamide
CID 34635942
4-methoxy-1-[4-(trifluoromethyl)phenyl]butan-2-ol
CID 55095519
4-methylsulfanyl-1-[4-(trifluoromethyl)phenyl]butan-2-ol
CID 65148752
2-methyl-3-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]propanoic acid
CID 55031151
(2R)-2-methyl-4-[4-[4-(trifluoromethyl)phenyl]phenyl]butanamide
CID 157198688
3-methyl-1-[4-(trifluoromethyl)phenyl]butan-2-one
CID 21016485

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide?
The IUPAC name of (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide (CID 110027716) is (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide.
What is the SMILES notation for (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide?
The canonical SMILES for (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide is C[C@H](C(N)=O)N(C)CC(O)Cc1ccc(C(F)(F)F)cc1.
What is the InChIKey of (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide?
The InChIKey is PNYGOHMPIADUQU-PKEIRNPWSA-N. The full InChI is InChI=1S/C14H19F3N2O2/c1-9(13(18)21)19(2)8-12(20)7-10-3-5-11(6-4-10)14(15,16)17/h3-6,9,12,20H,7-8H2,1-2H3,(H2,18,21)/t9-,12?/m1/s1.
What are the key properties of (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide?
(2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide has a molecular weight of 304.31 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[2-hydroxy-3-[4-(trifluoromethyl)phenyl]propyl]-methylamino]propanamide is sourced from PubChem (CID 110027716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).