3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol

C10H19F3N2O — CID 83021339

IUPAC3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol
SMILESCC1CCCC(C)N1NCC(O)C(F)(F)F
InChIInChI=1S/C10H19F3N2O/c1-7-4-3-5-8(2)15(7)14-6-9(16)10(11,12)13/h7-9,14,16H,3-6H2,1-2H3
InChIKeyJMOCLMKZWHJTAT-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.68
Rot. Bonds3

About 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol

3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol (PubChem CID 83021339) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol.

Molecular Properties

Compound Name3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol
PubChem CID83021339
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol
SMILESCC1CCCC(C)N1NCC(O)C(F)(F)F
InChIInChI=1S/C10H19F3N2O/c1-7-4-3-5-8(2)15(7)14-6-9(16)10(11,12)13/h7-9,14,16H,3-6H2,1-2H3
InChIKeyJMOCLMKZWHJTAT-UHFFFAOYSA-N
XLogP1.68
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol?
The IUPAC name of 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol (CID 83021339) is 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol.
What is the SMILES notation for 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol?
The canonical SMILES for 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol is CC1CCCC(C)N1NCC(O)C(F)(F)F.
What is the InChIKey of 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol?
The InChIKey is JMOCLMKZWHJTAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-7-4-3-5-8(2)15(7)14-6-9(16)10(11,12)13/h7-9,14,16H,3-6H2,1-2H3.
What are the key properties of 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol?
3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol has a molecular weight of 240.27 g/mol, XLogP of 1.68, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,6-dimethylpiperidin-1-yl)amino]-1,1,1-trifluoropropan-2-ol is sourced from PubChem (CID 83021339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).