[1-(2,2-difluoroethylamino)cyclopentyl]methanol

C8H15F2NO — CID 62519180

IUPAC[1-(2,2-difluoroethylamino)cyclopentyl]methanol
SMILESOCC1(NCC(F)F)CCCC1
InChIInChI=1S/C8H15F2NO/c9-7(10)5-11-8(6-12)3-1-2-4-8/h7,11-12H,1-6H2
InChIKeyMEKOYSGAPSXRMB-UHFFFAOYSA-N
MW179.21 g/mol
LogP1.15
Rot. Bonds4

About [1-(2,2-difluoroethylamino)cyclopentyl]methanol

[1-(2,2-difluoroethylamino)cyclopentyl]methanol (PubChem CID 62519180) has the molecular formula C8H15F2NO and a molecular weight of 179.21 g/mol. Its IUPAC name is [1-(2,2-difluoroethylamino)cyclopentyl]methanol.

Molecular Properties

Compound Name[1-(2,2-difluoroethylamino)cyclopentyl]methanol
PubChem CID62519180
Molecular FormulaC8H15F2NO
Molecular Weight179.21 g/mol
Exact Mass179.11
IUPAC Name[1-(2,2-difluoroethylamino)cyclopentyl]methanol
SMILESOCC1(NCC(F)F)CCCC1
InChIInChI=1S/C8H15F2NO/c9-7(10)5-11-8(6-12)3-1-2-4-8/h7,11-12H,1-6H2
InChIKeyMEKOYSGAPSXRMB-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.21
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(2,2-difluoroethylamino)cyclopentyl]methanol?
The IUPAC name of [1-(2,2-difluoroethylamino)cyclopentyl]methanol (CID 62519180) is [1-(2,2-difluoroethylamino)cyclopentyl]methanol.
What is the SMILES notation for [1-(2,2-difluoroethylamino)cyclopentyl]methanol?
The canonical SMILES for [1-(2,2-difluoroethylamino)cyclopentyl]methanol is OCC1(NCC(F)F)CCCC1.
What is the InChIKey of [1-(2,2-difluoroethylamino)cyclopentyl]methanol?
The InChIKey is MEKOYSGAPSXRMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO/c9-7(10)5-11-8(6-12)3-1-2-4-8/h7,11-12H,1-6H2.
What are the key properties of [1-(2,2-difluoroethylamino)cyclopentyl]methanol?
[1-(2,2-difluoroethylamino)cyclopentyl]methanol has a molecular weight of 179.21 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,2-difluoroethylamino)cyclopentyl]methanol is sourced from PubChem (CID 62519180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).