3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol

C10H13F3N2O — CID 135145291

IUPAC3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol
SMILESCNCCC(O)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C10H13F3N2O/c1-14-6-5-8(16)7-3-2-4-9(15-7)10(11,12)13/h2-4,8,14,16H,5-6H2,1H3
InChIKeyAWMRCXZLOLCWQI-UHFFFAOYSA-N
MW234.22 g/mol
LogP1.74
Rot. Bonds4

About 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol

3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol (PubChem CID 135145291) has the molecular formula C10H13F3N2O and a molecular weight of 234.22 g/mol. Its IUPAC name is 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol
PubChem CID135145291
Molecular FormulaC10H13F3N2O
Molecular Weight234.22 g/mol
Exact Mass234.10
IUPAC Name3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol
SMILESCNCCC(O)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C10H13F3N2O/c1-14-6-5-8(16)7-3-2-4-9(15-7)10(11,12)13/h2-4,8,14,16H,5-6H2,1H3
InChIKeyAWMRCXZLOLCWQI-UHFFFAOYSA-N
XLogP1.74
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,2-Bis(6-methyl-2-pyridyl)ethanediol
CID 96212
6-Methyl-2-pyridylmethanol
CID 70736
2,6-Pyridinedimethanol
CID 70957
alpha-Methyl-2-pyridinemethanol
CID 86784
(1R)-1-(pyridin-2-yl)ethan-1-ol
CID 642847
1-(6-(1-Hydroxy-ethyl)-pyridin-2-YL)-ethanol
CID 4363597
(1S)-1-(pyridin-2-yl)ethan-1-ol
CID 11094597
1-(6-Methylpyridin-2-yl)ethanol
CID 353138
(1S)-2-(tert-butylamino)-1-[4-(trifluoromethyl)pyridin-2-yl]ethanol
CID 155154292
(1S)-2-(tert-butylamino)-1-[6-(trifluoromethyl)pyridin-2-yl]ethanol
CID 155154344
(1R)-1-(pyridin-2-yl)propan-1-ol
CID 11434983
[6-(Trifluoromethyl)pyridin-2-yl]methanol
CID 14761464

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol?
The IUPAC name of 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol (CID 135145291) is 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol?
The canonical SMILES for 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol is CNCCC(O)c1cccc(C(F)(F)F)n1.
What is the InChIKey of 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol?
The InChIKey is AWMRCXZLOLCWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N2O/c1-14-6-5-8(16)7-3-2-4-9(15-7)10(11,12)13/h2-4,8,14,16H,5-6H2,1H3.
What are the key properties of 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol?
3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol has a molecular weight of 234.22 g/mol, XLogP of 1.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-1-[6-(trifluoromethyl)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 135145291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).