trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol

C5H9F2NO — CID 105427899

IUPACtrans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol
SMILESN[C@@H]1CC(F)(F)C[C@H]1O
InChIInChI=1S/C5H9F2NO/c6-5(7)1-3(8)4(9)2-5/h3-4,9H,1-2,8H2/t3-,4-/m1/s1
InChIKeyCIDGQJFAPODFAK-QWWZWVQMSA-N
MW137.13 g/mol
LogP0.10
Rot. Bonds

About trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol

trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol (PubChem CID 105427899) has the molecular formula C5H9F2NO and a molecular weight of 137.13 g/mol. Its IUPAC name is trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol
PubChem CID105427899
Molecular FormulaC5H9F2NO
Molecular Weight137.13 g/mol
Exact Mass137.07
IUPAC Nametrans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol
SMILESN[C@@H]1CC(F)(F)C[C@H]1O
InChIInChI=1S/C5H9F2NO/c6-5(7)1-3(8)4(9)2-5/h3-4,9H,1-2,8H2/t3-,4-/m1/s1
InChIKeyCIDGQJFAPODFAK-QWWZWVQMSA-N
XLogP0.10
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.13
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

rac-(1R,2R)-2-aminocyclopentan-1-ol
CID 10464306
NoName_4581
CID 143443
(1S,2S)-2-aminocyclopentan-1-ol hydrochloride
CID 16211106
(1R,2R)-2-aminocyclopentan-1-ol hydrochloride
CID 12886906
(1R,2S)-2-aminocyclopentan-1-ol hydrochloride
CID 16211105
(1S,2R)-2-aminocyclopentan-1-ol hydrochloride
CID 17039404
rac-(1R,2R)-2-(difluoromethoxy)cyclopentan-1-amine
CID 91663012
(1S,2R)-2-Aminocyclopentanol
CID 12886904
trans 2-Hydroxycyclopentan-2-aminium chloride
CID 139071897
rac-(1R,5S)-5-amino-2,2-difluorocyclopentan-1-ol hydrochloride
CID 137943595
(1R,2S,3S,5S)-2,5-diamino-3-fluorocyclopentan-1-ol
CID 55284562
(1S,2S)-2-Aminocyclopentanol
CID 11571787

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol?
The IUPAC name of trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol (CID 105427899) is trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol.
What is the SMILES notation for trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol?
The canonical SMILES for trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol is N[C@@H]1CC(F)(F)C[C@H]1O.
What is the InChIKey of trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol?
The InChIKey is CIDGQJFAPODFAK-QWWZWVQMSA-N. The full InChI is InChI=1S/C5H9F2NO/c6-5(7)1-3(8)4(9)2-5/h3-4,9H,1-2,8H2/t3-,4-/m1/s1.
What are the key properties of trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol?
trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol has a molecular weight of 137.13 g/mol, XLogP of 0.10, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-amino-4,4-difluorocyclopentan-1-ol is sourced from PubChem (CID 105427899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).