propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol

C7H15F3N2O2 — CID 144699261

IUPACpropanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol
SMILESCCC(N)=O.CNCC(O)C(F)(F)F
InChIInChI=1S/C4H8F3NO.C3H7NO/c1-8-2-3(9)4(5,6)7;1-2-3(4)5/h3,8-9H,2H2,1H3;2H2,1H3,(H2,4,5)
InChIKeyQLTRYOUFUOHCDN-UHFFFAOYSA-N
MW216.20 g/mol
LogP0.01
Rot. Bonds3

About propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol

propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol (PubChem CID 144699261) has the molecular formula C7H15F3N2O2 and a molecular weight of 216.20 g/mol. Its IUPAC name is propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol.

Molecular Properties

Compound Namepropanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol
PubChem CID144699261
Molecular FormulaC7H15F3N2O2
Molecular Weight216.20 g/mol
Exact Mass216.11
IUPAC Namepropanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol
SMILESCCC(N)=O.CNCC(O)C(F)(F)F
InChIInChI=1S/C4H8F3NO.C3H7NO/c1-8-2-3(9)4(5,6)7;1-2-3(4)5/h3,8-9H,2H2,1H3;2H2,1H3,(H2,4,5)
InChIKeyQLTRYOUFUOHCDN-UHFFFAOYSA-N
XLogP0.01
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 50.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol?
The IUPAC name of propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol (CID 144699261) is propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol.
What is the SMILES notation for propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol?
The canonical SMILES for propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol is CCC(N)=O.CNCC(O)C(F)(F)F.
What is the InChIKey of propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol?
The InChIKey is QLTRYOUFUOHCDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F3NO.C3H7NO/c1-8-2-3(9)4(5,6)7;1-2-3(4)5/h3,8-9H,2H2,1H3;2H2,1H3,(H2,4,5).
What are the key properties of propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol?
propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol has a molecular weight of 216.20 g/mol, XLogP of 0.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propanamide;1,1,1-trifluoro-3-(methylamino)propan-2-ol is sourced from PubChem (CID 144699261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).