1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol

C13H22F3NO — CID 103159925

IUPAC1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol
SMILESOC(CC1CCCC1)CN(CC(F)(F)F)C1CC1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)9-17(11-5-6-11)8-12(18)7-10-3-1-2-4-10/h10-12,18H,1-9H2
InChIKeyYPSKCCNUWNKBCJ-UHFFFAOYSA-N
MW265.32 g/mol
LogP2.95
Rot. Bonds6

About 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol

1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol (PubChem CID 103159925) has the molecular formula C13H22F3NO and a molecular weight of 265.32 g/mol. Its IUPAC name is 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol.

Molecular Properties

Compound Name1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol
PubChem CID103159925
Molecular FormulaC13H22F3NO
Molecular Weight265.32 g/mol
Exact Mass265.17
IUPAC Name1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol
SMILESOC(CC1CCCC1)CN(CC(F)(F)F)C1CC1
InChIInChI=1S/C13H22F3NO/c14-13(15,16)9-17(11-5-6-11)8-12(18)7-10-3-1-2-4-10/h10-12,18H,1-9H2
InChIKeyYPSKCCNUWNKBCJ-UHFFFAOYSA-N
XLogP2.95
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,3-Difluorocyclopentyl)-2-(dimethylamino)ethanol
CID 134603272
2-[Cyclopropyl(2,2,2-trifluoroethyl)amino]cyclooctan-1-ol
CID 61764381
2-[Cyclopropyl(2,2,2-trifluoroethyl)amino]-4-propylcyclohexan-1-ol
CID 61765153
2-[Cyclopropyl(2,2,2-trifluoroethyl)amino]-4-ethylcyclohexan-1-ol
CID 61765349
2-[[Cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-ol
CID 62608869
2-[[Cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cycloheptan-1-ol
CID 62608870
2-[[Cyclopropyl(2,2,2-trifluoroethyl)amino]methyl]cyclohexan-1-ol
CID 62609560
4,4,4-Trifluoro-1-(1-pyrrolidin-1-ylcyclopentyl)butan-1-ol
CID 79057691
4,4,4-Trifluoro-1-(1-piperidin-1-ylcyclopentyl)butan-1-ol
CID 79060200
1-[1-(Dimethylamino)cyclopentyl]-4,4,4-trifluorobutan-1-ol
CID 79068102
1-[1-(Diethylamino)cyclopentyl]-4,4,4-trifluorobutan-1-ol
CID 79070250
2-[2-[Propan-2-yl(2,2,2-trifluoroethyl)amino]ethyl]cyclopentan-1-ol
CID 79564543

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
The IUPAC name of 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol (CID 103159925) is 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol.
What is the SMILES notation for 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
The canonical SMILES for 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol is OC(CC1CCCC1)CN(CC(F)(F)F)C1CC1.
What is the InChIKey of 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
The InChIKey is YPSKCCNUWNKBCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22F3NO/c14-13(15,16)9-17(11-5-6-11)8-12(18)7-10-3-1-2-4-10/h10-12,18H,1-9H2.
What are the key properties of 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol?
1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol has a molecular weight of 265.32 g/mol, XLogP of 2.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-[cyclopropyl(2,2,2-trifluoroethyl)amino]propan-2-ol is sourced from PubChem (CID 103159925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).