2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide

C8H15N3O7 — CID 7348661

IUPAC2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide
SMILESNC(=O)C(=O)NN[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C8H15N3O7/c9-6(16)7(17)10-11-8-5(15)4(14)3(13)2(1-12)18-8/h2-5,8,11-15H,1H2,(H2,9,16)(H,10,17)/t2-,3+,4+,5+,8-/m1/s1
InChIKeyPAJXWCUINJDMAA-POLWSVIISA-N
MW265.22 g/mol
LogP-5.11
Rot. Bonds3

About 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide

2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide (PubChem CID 7348661) has the molecular formula C8H15N3O7 and a molecular weight of 265.22 g/mol. Its IUPAC name is 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide.

Molecular Properties

Compound Name2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide
PubChem CID7348661
Molecular FormulaC8H15N3O7
Molecular Weight265.22 g/mol
Exact Mass265.09
IUPAC Name2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide
SMILESNC(=O)C(=O)NN[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O
InChIInChI=1S/C8H15N3O7/c9-6(16)7(17)10-11-8-5(15)4(14)3(13)2(1-12)18-8/h2-5,8,11-15H,1H2,(H2,9,16)(H,10,17)/t2-,3+,4+,5+,8-/m1/s1
InChIKeyPAJXWCUINJDMAA-POLWSVIISA-N
XLogP-5.11
TPSA174.37 Ų
H-Bond Donors7
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.22
LogP ≤ 5-5.11
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide with MolForge

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Related Compounds

6-oxo-6-[2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]hexanoic acid
CID 69245387
1,3-bis[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]urea
CID 5239774
2-azido-N'-[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]acetohydrazide
CID 132933564
1-methyl-3-[[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]thiourea
CID 124909209
[(3S,4R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]thiourea
CID 3035110
[(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]thiourea;hydrobromide
CID 176657613
2-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]guanidine
CID 3837727
(2R)-3-sulfanyl-2-[[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]propanamide
CID 175726634
1-(diaminomethylidene)-3-[(2R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]urea
CID 58400267
2-(hydroxymethyl)-6-[2-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]amino]ethylamino]oxane-3,4,5-triol
CID 85428971
2-amino-N-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]acetamide;hydrochloride
CID 171381064
2-bromo-N-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]acetamide
CID 6453781

Frequently Asked Questions

What is the IUPAC name of 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide?
The IUPAC name of 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide (CID 7348661) is 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide.
What is the SMILES notation for 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide?
The canonical SMILES for 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide is NC(=O)C(=O)NN[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@@H]1O.
What is the InChIKey of 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide?
The InChIKey is PAJXWCUINJDMAA-POLWSVIISA-N. The full InChI is InChI=1S/C8H15N3O7/c9-6(16)7(17)10-11-8-5(15)4(14)3(13)2(1-12)18-8/h2-5,8,11-15H,1H2,(H2,9,16)(H,10,17)/t2-,3+,4+,5+,8-/m1/s1.
What are the key properties of 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide?
2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide has a molecular weight of 265.22 g/mol, XLogP of -5.11, 3 rotatable bonds, 7 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-2-[2-[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]hydrazinyl]acetamide is sourced from PubChem (CID 7348661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).