(2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide

C5H11F3N2O2S — CID 130236496

IUPAC(2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide
SMILESC[C@@H](N)CS(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C5H11F3N2O2S/c1-4(9)2-13(11,12)10-3-5(6,7)8/h4,10H,2-3,9H2,1H3/t4-/m1/s1
InChIKeyQMXSOZGXWUJIGK-SCSAIBSYSA-N
MW220.22 g/mol
LogP-0.18
Rot. Bonds4

About (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide

(2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide (PubChem CID 130236496) has the molecular formula C5H11F3N2O2S and a molecular weight of 220.22 g/mol. Its IUPAC name is (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide
PubChem CID130236496
Molecular FormulaC5H11F3N2O2S
Molecular Weight220.22 g/mol
Exact Mass220.05
IUPAC Name(2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide
SMILESC[C@@H](N)CS(=O)(=O)NCC(F)(F)F
InChIInChI=1S/C5H11F3N2O2S/c1-4(9)2-13(11,12)10-3-5(6,7)8/h4,10H,2-3,9H2,1H3/t4-/m1/s1
InChIKeyQMXSOZGXWUJIGK-SCSAIBSYSA-N
XLogP-0.18
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(propan-2-yl)ethane-1-sulfonamide hydrochloride
CID 47002472
2-amino-N,N-dimethylpropane-1-sulfonamide
CID 82074759
2-amino-3,3,3-trifluoro-N,N-dimethylpropane-1-sulfonamide
CID 119030899
N-butan-2-yl-1,1,1-trifluoromethanesulfonamide
CID 14663477
N-ethyl-2,2,2-trifluoroethanesulfonamide
CID 20718448
N-(2,2-dimethylpropyl)-2,2,2-trifluoroethanesulfonamide
CID 21027126
N-(2,2,2-trifluoroethyl)butane-2-sulfonamide
CID 21029736
Isopropyl(trifluoromethylsulfonyl)amine
CID 22908457
2-amino-N-(2,2,2-trifluoroethyl)ethanesulfonamide
CID 24691755
N-ethyl-2,2-difluoroethanesulfonamide
CID 54439869
N-(3-aminobutan-2-yl)-1,1,1-trifluoromethanesulfonamide
CID 56992749
2,2-difluoro-N-propan-2-ylpropane-1-sulfonamide
CID 58525236

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide?
The IUPAC name of (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide (CID 130236496) is (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide.
What is the SMILES notation for (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide?
The canonical SMILES for (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide is C[C@@H](N)CS(=O)(=O)NCC(F)(F)F.
What is the InChIKey of (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide?
The InChIKey is QMXSOZGXWUJIGK-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H11F3N2O2S/c1-4(9)2-13(11,12)10-3-5(6,7)8/h4,10H,2-3,9H2,1H3/t4-/m1/s1.
What are the key properties of (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide?
(2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide has a molecular weight of 220.22 g/mol, XLogP of -0.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(2,2,2-trifluoroethyl)propane-1-sulfonamide is sourced from PubChem (CID 130236496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).