1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol

C8H14F3NO — CID 130532216

IUPAC1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol
SMILESCC1(O)CCCC1NCC(F)(F)F
InChIInChI=1S/C8H14F3NO/c1-7(13)4-2-3-6(7)12-5-8(9,10)11/h6,12-13H,2-5H2,1H3
InChIKeyBRMGKSIIJLEPQJ-UHFFFAOYSA-N
MW197.20 g/mol
LogP1.44
Rot. Bonds2

About 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol

1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol (PubChem CID 130532216) has the molecular formula C8H14F3NO and a molecular weight of 197.20 g/mol. Its IUPAC name is 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol.

Molecular Properties

Compound Name1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol
PubChem CID130532216
Molecular FormulaC8H14F3NO
Molecular Weight197.20 g/mol
Exact Mass197.10
IUPAC Name1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol
SMILESCC1(O)CCCC1NCC(F)(F)F
InChIInChI=1S/C8H14F3NO/c1-7(13)4-2-3-6(7)12-5-8(9,10)11/h6,12-13H,2-5H2,1H3
InChIKeyBRMGKSIIJLEPQJ-UHFFFAOYSA-N
XLogP1.44
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.20
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methyl-2-(methylamino)cyclopentan-1-ol
CID 67051509
2-[Hexyl(pentyl)amino]-1-(trifluoromethyl)cyclopentan-1-ol
CID 69368116
1,1,1-trifluoro-2-[(2S)-pyrrolidin-2-yl]propan-2-ol
CID 70321196
2-[(2S)-4,4-difluoropyrrolidin-2-yl]propan-2-ol
CID 89826230
2-(4,4-Difluoropyrrolidin-2-yl)propan-2-ol
CID 89826233
(2S)-1,1,1-trifluoro-2-[(2S)-pyrrolidin-2-yl]propan-2-ol
CID 142507424
trans-(1S,2R)-2-(2-methylpropylamino)-1-(trifluoromethyl)cyclopentan-1-ol
CID 167273949
trans-(1S,2R)-2-(tert-butylamino)-1-methylcyclopentan-1-ol
CID 134992791
1-[(3,3,3-Trifluoropropylamino)methyl]cyclopentan-1-ol
CID 65108895
1-{[(2,2,2-Trifluoroethyl)amino]methyl}cyclopentan-1-ol
CID 65108996
1-[(2,2-Difluoroethylamino)methyl]cyclopentan-1-ol
CID 65109046
1,1,1-Trifluoro-2-pyrrolidin-2-ylpropan-2-ol
CID 77822150

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol?
The IUPAC name of 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol (CID 130532216) is 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol.
What is the SMILES notation for 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol?
The canonical SMILES for 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol is CC1(O)CCCC1NCC(F)(F)F.
What is the InChIKey of 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol?
The InChIKey is BRMGKSIIJLEPQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3NO/c1-7(13)4-2-3-6(7)12-5-8(9,10)11/h6,12-13H,2-5H2,1H3.
What are the key properties of 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol?
1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol has a molecular weight of 197.20 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(2,2,2-trifluoroethylamino)cyclopentan-1-ol is sourced from PubChem (CID 130532216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).