2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol

C11H21F3N2O — CID 103366083

IUPAC2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol
SMILESNCC(CN1CCCCC1CCO)C(F)(F)F
InChIInChI=1S/C11H21F3N2O/c12-11(13,14)9(7-15)8-16-5-2-1-3-10(16)4-6-17/h9-10,17H,1-8,15H2
InChIKeyHEVYCUOAZRSNPO-UHFFFAOYSA-N
MW254.30 g/mol
LogP1.36
Rot. Bonds5

About 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol

2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol (PubChem CID 103366083) has the molecular formula C11H21F3N2O and a molecular weight of 254.30 g/mol. Its IUPAC name is 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol
PubChem CID103366083
Molecular FormulaC11H21F3N2O
Molecular Weight254.30 g/mol
Exact Mass254.16
IUPAC Name2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol
SMILESNCC(CN1CCCCC1CCO)C(F)(F)F
InChIInChI=1S/C11H21F3N2O/c12-11(13,14)9(7-15)8-16-5-2-1-3-10(16)4-6-17/h9-10,17H,1-8,15H2
InChIKeyHEVYCUOAZRSNPO-UHFFFAOYSA-N
XLogP1.36
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(Trifluoromethyl)piperidin-2-yl]ethanol
CID 44295821
2,2-Difluoro-2-(piperidin-2-yl)ethan-1-ol
CID 146155546
[2-[[1-(3,3,3-Trifluoropropyl)piperidin-4-yl]amino]cycloheptyl]methanol
CID 86785650
2-[6-(Difluoromethyl)piperidin-2-yl]ethanol
CID 177971140
2-[1-(3-Amino-1,1,1-trifluoropropan-2-yl)piperidin-2-yl]ethanol
CID 43752650
2-[1-(4-Amino-1,1,1-trifluorobutan-2-yl)piperidin-2-yl]ethanol
CID 43753082
[1-(4-Amino-1,1,1-trifluorobutan-2-yl)piperidin-3-yl]methanol
CID 43753184
2-[1-(3,3,3-Trifluoropropyl)piperidin-2-yl]ethanol
CID 60690266
[1-(4-Amino-1,1,1-trifluorobutan-2-yl)piperidin-2-yl]methanol
CID 61406587
2-[1-(3-Amino-1,1,1-trifluorobutan-2-yl)piperidin-2-yl]ethanol
CID 61647543
2-[1-(3-Amino-1,1,1-trifluoropentan-2-yl)piperidin-2-yl]ethanol
CID 61647544
2-[1-(2,2,2-Trifluoroethyl)piperidin-2-yl]ethanol
CID 62020095

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol (CID 103366083) is 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol is NCC(CN1CCCCC1CCO)C(F)(F)F.
What is the InChIKey of 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol?
The InChIKey is HEVYCUOAZRSNPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O/c12-11(13,14)9(7-15)8-16-5-2-1-3-10(16)4-6-17/h9-10,17H,1-8,15H2.
What are the key properties of 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol?
2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol has a molecular weight of 254.30 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(aminomethyl)-3,3,3-trifluoropropyl]piperidin-2-yl]ethanol is sourced from PubChem (CID 103366083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).