(2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol

C5H11NO5 — CID 134274851

IUPAC(2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol
SMILESN[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C5H11NO5/c6-4-2(8)1(7)3(9)5(10)11-4/h1-5,7-10H,6H2/t1-,2+,3+,4-,5-/m0/s1
InChIKeySGRNQBRQCKQFTH-FOJGRBBPSA-N
MW165.15 g/mol
LogP-3.30
Rot. Bonds

About (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol

(2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol (PubChem CID 134274851) has the molecular formula C5H11NO5 and a molecular weight of 165.15 g/mol. Its IUPAC name is (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol.

Molecular Properties

Compound Name(2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol
PubChem CID134274851
Molecular FormulaC5H11NO5
Molecular Weight165.15 g/mol
Exact Mass165.06
IUPAC Name(2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol
SMILESN[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C5H11NO5/c6-4-2(8)1(7)3(9)5(10)11-4/h1-5,7-10H,6H2/t1-,2+,3+,4-,5-/m0/s1
InChIKeySGRNQBRQCKQFTH-FOJGRBBPSA-N
XLogP-3.30
TPSA116.17 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.15
LogP ≤ 5-3.30
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

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Related Compounds

(4S,5S)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol
CID 174104618
(2R,3R,4S,5R,6R)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol
CID 11095207
(2S,5R)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol
CID 59101286
(2S,3R,5R)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol
CID 155653214
(2R,3S,4R,5R,6S)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol
CID 94005021
(3R,4S,5R,6R)-2-amino-6-(hydroxymethyl)oxane-3,4,5-triol
CID 11665493
(3S,4S)-oxolane-2,3,4,5-tetrol
CID 89085944
(2S,3R,4S,5S,6R)-2-amino-6-methyloxane-3,4,5-triol
CID 70182320
2-amino-6-methyloxane-3,4,5-triol
CID 4218932
5-amino-3-(methylamino)oxolane-2,4-diol
CID 123760339
2,5-diamino-6-(hydroxymethyl)oxane-3,4-diol
CID 176999192
(3R,4S,6R)-3-amino-2,7-dioxabicyclo[4.1.0]heptane-4,5-diol
CID 163838966

Frequently Asked Questions

What is the IUPAC name of (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol?
The IUPAC name of (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol (CID 134274851) is (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol.
What is the SMILES notation for (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol?
The canonical SMILES for (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol is N[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1O.
What is the InChIKey of (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol?
The InChIKey is SGRNQBRQCKQFTH-FOJGRBBPSA-N. The full InChI is InChI=1S/C5H11NO5/c6-4-2(8)1(7)3(9)5(10)11-4/h1-5,7-10H,6H2/t1-,2+,3+,4-,5-/m0/s1.
What are the key properties of (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol?
(2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol has a molecular weight of 165.15 g/mol, XLogP of -3.30, 0 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R,4S,5R,6S)-6-aminooxane-2,3,4,5-tetrol is sourced from PubChem (CID 134274851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).