(1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol

C5H11FN2O — CID 102050550

IUPAC(1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol
SMILESN[C@@H]1C[C@H](N)[C@H](F)[C@H]1O
InChIInChI=1S/C5H11FN2O/c6-4-2(7)1-3(8)5(4)9/h2-5,9H,1,7-8H2/t2-,3+,4-,5-/m0/s1
InChIKeyWPCDXDCVQZYGLU-QTBDOELSSA-N
MW134.15 g/mol
LogP-1.26
Rot. Bonds

About (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol

(1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol (PubChem CID 102050550) has the molecular formula C5H11FN2O and a molecular weight of 134.15 g/mol. Its IUPAC name is (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol.

Molecular Properties

Compound Name(1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol
PubChem CID102050550
Molecular FormulaC5H11FN2O
Molecular Weight134.15 g/mol
Exact Mass134.09
IUPAC Name(1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol
SMILESN[C@@H]1C[C@H](N)[C@H](F)[C@H]1O
InChIInChI=1S/C5H11FN2O/c6-4-2(7)1-3(8)5(4)9/h2-5,9H,1,7-8H2/t2-,3+,4-,5-/m0/s1
InChIKeyWPCDXDCVQZYGLU-QTBDOELSSA-N
XLogP-1.26
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.15
LogP ≤ 5-1.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-4,6-diamino-3-fluorocyclohexane-1,2-diol
CID 142537536
(1R,2R,3S,5S)-3-amino-2-fluoro-5-(hydroxymethyl)cyclopentan-1-ol
CID 121226647
(1R,3R,4R,6R)-4,6-diaminocyclohexane-1,2,3-triol
CID 6102588
cis-(4S,6R)-4,6-diaminocyclohexane-1,2,3-triol
CID 25245099
(1S,3R,4R,6R)-4,6-diaminocyclohexane-1,2,3-triol
CID 98290063
(1R,2S,3S,5S)-3-amino-5-(hydroxymethyl)cyclopentane-1,2-diol
CID 171920949
(1R,2R,3S,5S)-3-amino-5-(hydroxymethyl)cyclopentane-1,2-diol
CID 18651921
4-amino-3-fluoro-2-(hydroxymethyl)cyclopentan-1-ol
CID 14888493
2-fluorocyclopropan-1-amine
CID 10197614
(1R,2S,3R,4R,6R)-4-amino-6-(hydroxymethyl)cyclohexane-1,2,3-triol
CID 10397334
(1R,2R,4R)-4-amino-2-fluorocyclopentan-1-ol
CID 55285503
(1S,2R,3S,4R)-4-aminocyclopentane-1,2,3-triol;hydrochloride
CID 73424715

Frequently Asked Questions

What is the IUPAC name of (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol?
The IUPAC name of (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol (CID 102050550) is (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol.
What is the SMILES notation for (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol?
The canonical SMILES for (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol is N[C@@H]1C[C@H](N)[C@H](F)[C@H]1O.
What is the InChIKey of (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol?
The InChIKey is WPCDXDCVQZYGLU-QTBDOELSSA-N. The full InChI is InChI=1S/C5H11FN2O/c6-4-2(7)1-3(8)5(4)9/h2-5,9H,1,7-8H2/t2-,3+,4-,5-/m0/s1.
What are the key properties of (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol?
(1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol has a molecular weight of 134.15 g/mol, XLogP of -1.26, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S,3S,5R)-3,5-diamino-2-fluorocyclopentan-1-ol is sourced from PubChem (CID 102050550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).