1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol

C11H20F3NO — CID 65212783

IUPAC1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
SMILESCC(C)N(CC(F)(F)F)CC1(O)CCCC1
InChIInChI=1S/C11H20F3NO/c1-9(2)15(8-11(12,13)14)7-10(16)5-3-4-6-10/h9,16H,3-8H2,1-2H3
InChIKeyAUHBTIJHYPBXAL-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.56
Rot. Bonds4

About 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol

1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol (PubChem CID 65212783) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
PubChem CID65212783
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC Name1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
SMILESCC(C)N(CC(F)(F)F)CC1(O)CCCC1
InChIInChI=1S/C11H20F3NO/c1-9(2)15(8-11(12,13)14)7-10(16)5-3-4-6-10/h9,16H,3-8H2,1-2H3
InChIKeyAUHBTIJHYPBXAL-UHFFFAOYSA-N
XLogP2.56
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[Hexyl(pentyl)amino]-1-(trifluoromethyl)cyclopentan-1-ol
CID 69368116
[4-(Fluoromethyl)-4-hydroxyhexan-3-yl]-trimethylazanium
CID 87169825
2-[(2R)-1-tert-butyl-4,4-difluoropyrrolidin-2-yl]propan-2-ol
CID 155201050
(S)-2-(4,4-Difluoro-1-methylpyrrolidin-2-YL)propan-2-OL
CID 165405834
(3S)-1,5-di(propan-2-yl)-3-(trifluoromethyl)pyrrolidin-3-ol
CID 169651693
1,1,1-trifluoro-2-[(2S)-1-propan-2-ylpyrrolidin-2-yl]propan-2-ol
CID 170366282
2-[(2S)-1-ethylpyrrolidin-2-yl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 174164358
2-(4,4-Difluoro-1-methylpyrrolidin-2-yl)propan-2-ol
CID 174189675
6,6-Difluoro-3-methyl-1-propan-2-ylazepan-3-ol
CID 178173046
1-Cyclopropyl-3-(3,3,3-trifluoropropyl)pyrrolidin-3-ol
CID 64566579
1-[[Propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclohexan-1-ol
CID 65208481
1-[[Ethyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 65212677

Frequently Asked Questions

What is the IUPAC name of 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol (CID 65212783) is 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol is CC(C)N(CC(F)(F)F)CC1(O)CCCC1.
What is the InChIKey of 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is AUHBTIJHYPBXAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-9(2)15(8-11(12,13)14)7-10(16)5-3-4-6-10/h9,16H,3-8H2,1-2H3.
What are the key properties of 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol?
1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 239.28 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 65212783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).