N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide

C8H13NO6 — CID 91850724

IUPACN-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide
SMILESCC(=O)N[C@H]1[C@H](O)O[C@H](CO)C(=O)[C@@H]1O
InChIInChI=1S/C8H13NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-5,7-8,10,13-14H,2H2,1H3,(H,9,11)/t4-,5-,7-,8-/m1/s1
InChIKeyQWNUIHUYQCXPAP-SJNFNFGESA-N
MW219.19 g/mol
LogP-2.87
Rot. Bonds2

About N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide

N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide (PubChem CID 91850724) has the molecular formula C8H13NO6 and a molecular weight of 219.19 g/mol. Its IUPAC name is N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide
PubChem CID91850724
Molecular FormulaC8H13NO6
Molecular Weight219.19 g/mol
Exact Mass219.07
IUPAC NameN-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide
SMILESCC(=O)N[C@H]1[C@H](O)O[C@H](CO)C(=O)[C@@H]1O
InChIInChI=1S/C8H13NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-5,7-8,10,13-14H,2H2,1H3,(H,9,11)/t4-,5-,7-,8-/m1/s1
InChIKeyQWNUIHUYQCXPAP-SJNFNFGESA-N
XLogP-2.87
TPSA116.09 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.19
LogP ≤ 5-2.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide with MolForge

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Related Compounds

N-(2,4-dihydroxy-6-methyl-5-oxooxan-3-yl)acetamide
CID 91847162
N-[(2R,3S,4S,5R)-2,4-dihydroxy-5-(hydroxymethyl)oxolan-3-yl]acetamide
CID 131118562
N-[(2S,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 11869611
N-[(4R,5R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 58718646
N-[(3S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 16757753
N-[(2R,3S,4S,5R,6S)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 11861101
phosphoric acid;N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 135349447
N-[(2S,3R,4S,5S,6R)-2,3,5-trihydroxy-6-(hydroxymethyl)oxan-4-yl]acetamide
CID 70004972
[(3S,4R)-5-acetamido-4-acetyloxy-6-hydroxy-2-(hydroxymethyl)oxan-3-yl] acetate
CID 71312900
N-[2,5-dihydroxy-4,6-bis(hydroxymethyl)oxan-3-yl]acetamide
CID 71079558
acetic acid;N-[(3R,4R,5R,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide;N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 158802071
N-[(3R,4R,6S)-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 14865842

Frequently Asked Questions

What is the IUPAC name of N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide?
The IUPAC name of N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide (CID 91850724) is N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide.
What is the SMILES notation for N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide?
The canonical SMILES for N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide is CC(=O)N[C@H]1[C@H](O)O[C@H](CO)C(=O)[C@@H]1O.
What is the InChIKey of N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide?
The InChIKey is QWNUIHUYQCXPAP-SJNFNFGESA-N. The full InChI is InChI=1S/C8H13NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-5,7-8,10,13-14H,2H2,1H3,(H,9,11)/t4-,5-,7-,8-/m1/s1.
What are the key properties of N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide?
N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide has a molecular weight of 219.19 g/mol, XLogP of -2.87, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R,3R,4R,6R)-2,4-dihydroxy-6-(hydroxymethyl)-5-oxooxan-3-yl]acetamide is sourced from PubChem (CID 91850724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).