1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol

C10H18F3NO2 — CID 63899261

IUPAC1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol
SMILESOCCC1CCCN(CC(O)C(F)(F)F)C1
InChIInChI=1S/C10H18F3NO2/c11-10(12,13)9(16)7-14-4-1-2-8(6-14)3-5-15/h8-9,15-16H,1-7H2
InChIKeyKFCAJZSBLDWANH-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.00
Rot. Bonds4

About 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol

1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol (PubChem CID 63899261) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol.

Molecular Properties

Compound Name1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol
PubChem CID63899261
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC Name1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol
SMILESOCCC1CCCN(CC(O)C(F)(F)F)C1
InChIInChI=1S/C10H18F3NO2/c11-10(12,13)9(16)7-14-4-1-2-8(6-14)3-5-15/h8-9,15-16H,1-7H2
InChIKeyKFCAJZSBLDWANH-UHFFFAOYSA-N
XLogP1.00
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]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

Related Compounds

1-(2-Hydroxyethyl)-4-piperidinepropanol
CID 88244
(1R*,3S*)-7-(4,4,4-trifluorobutyl)-7-azaspiro[3.5]nonane-1,3-diol
CID 72875743
1-[1-(2-Hydroxyethyl)piperidin-4-yl]propan-1-ol
CID 11970511
(3R,4R,5S)-1-butyl-5-(difluoromethyl)piperidine-3,4-diol
CID 51356490
(3S,5R)-1-methyl-5-(trifluoromethyl)piperidin-3-ol
CID 58177274
2-[1-(2,2,2-Trifluoroethyl)piperidin-3-yl]ethanol
CID 62357831
Butyl-5-(difluoromethyl)piperidine 3,4-diol
CID 75631375
1-Methyl-5-(trifluoromethyl)piperidin-3-ol
CID 76716097
3-[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]propan-1-ol
CID 89524570
1-(1-Ethylpiperidin-4-yl)-2,2,2-trifluoroethanol
CID 89584678
1,1,1-Trifluoro-3-[3-(3-methoxypropyl)-piperidin-1-yl]-propan-2-ol
CID 90103484
2,2,2-Trifluoro-1-(1-propylpiperidin-4-yl)ethanol
CID 112326754

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol?
The IUPAC name of 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol (CID 63899261) is 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol.
What is the SMILES notation for 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol?
The canonical SMILES for 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol is OCCC1CCCN(CC(O)C(F)(F)F)C1.
What is the InChIKey of 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol?
The InChIKey is KFCAJZSBLDWANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c11-10(12,13)9(16)7-14-4-1-2-8(6-14)3-5-15/h8-9,15-16H,1-7H2.
What are the key properties of 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol?
1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol has a molecular weight of 241.25 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-3-[3-(2-hydroxyethyl)piperidin-1-yl]propan-2-ol is sourced from PubChem (CID 63899261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).