2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol

C8H15F2NO2 — CID 106176943

IUPAC2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol
SMILESOCC(F)(F)CNC1CCCC1O
InChIInChI=1S/C8H15F2NO2/c9-8(10,5-12)4-11-6-2-1-3-7(6)13/h6-7,11-13H,1-5H2
InChIKeyNQFFFFKSUKDWMT-UHFFFAOYSA-N
MW195.21 g/mol
LogP0.12
Rot. Bonds4

About 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol

2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol (PubChem CID 106176943) has the molecular formula C8H15F2NO2 and a molecular weight of 195.21 g/mol. Its IUPAC name is 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol
PubChem CID106176943
Molecular FormulaC8H15F2NO2
Molecular Weight195.21 g/mol
Exact Mass195.11
IUPAC Name2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol
SMILESOCC(F)(F)CNC1CCCC1O
InChIInChI=1S/C8H15F2NO2/c9-8(10,5-12)4-11-6-2-1-3-7(6)13/h6-7,11-13H,1-5H2
InChIKeyNQFFFFKSUKDWMT-UHFFFAOYSA-N
XLogP0.12
TPSA52.49 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.21
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

rac-(1R,2R)-2-(cyclopropylamino)cyclopentan-1-ol
CID 92555045
3-(Cyclopentylamino)-1,1,1-trifluoropropan-2-ol
CID 2768009
2,2,2-trifluoro-N-[(1R,2R)-2-hydroxycyclopentyl]acetamide
CID 59134636
trans-(1R,2R)-2-(propan-2-ylamino)cyclopentan-1-ol
CID 338651
Cyclopentanol, 2-(butylamino)-, trans-
CID 93317320
2,2,2-trifluoro-N-[(2R)-2-hydroxycyclopentyl]acetamide
CID 358974
2,2,2-trifluoro-N-(2-hydroxycyclopentyl)acetamide
CID 5165012
cyclopentyl-[(2S)-3,3,3-trifluoro-2-hydroxypropyl]azanium
CID 7084589
(2S)-3-(cyclopentylamino)-1,1,1-trifluoropropan-2-ol
CID 7084590
cyclopentyl-[(2R)-3,3,3-trifluoro-2-hydroxypropyl]azanium
CID 7084591
(2R)-3-(cyclopentylamino)-1,1,1-trifluoropropan-2-ol
CID 7084592
2-[(2,2,2-Trifluoroethyl)amino]cyclopentan-1-ol
CID 60713697

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol?
The IUPAC name of 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol (CID 106176943) is 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol?
The canonical SMILES for 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol is OCC(F)(F)CNC1CCCC1O.
What is the InChIKey of 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol?
The InChIKey is NQFFFFKSUKDWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F2NO2/c9-8(10,5-12)4-11-6-2-1-3-7(6)13/h6-7,11-13H,1-5H2.
What are the key properties of 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol?
2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol has a molecular weight of 195.21 g/mol, XLogP of 0.12, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-difluoro-3-hydroxypropyl)amino]cyclopentan-1-ol is sourced from PubChem (CID 106176943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).