2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide

C12H18N4O6 — CID 11267003

IUPAC2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide
SMILESCC(=O)NCC(=O)Nc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1
InChIInChI=1S/C12H18N4O6/c1-6(18)13-2-9(19)15-8-3-16(5-14-8)12-11(21)10(20)7(4-17)22-12/h3,5,7,10-12,17,20-21H,2,4H2,1H3,(H,13,18)(H,15,19)/t7-,10-,11-,12-/m1/s1
InChIKeyJGEZIOXIJODKPS-FAQVLOEFSA-N
MW314.30 g/mol
LogP-2.43
Rot. Bonds5

About 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide

2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide (PubChem CID 11267003) has the molecular formula C12H18N4O6 and a molecular weight of 314.30 g/mol. Its IUPAC name is 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide
PubChem CID11267003
Molecular FormulaC12H18N4O6
Molecular Weight314.30 g/mol
Exact Mass314.12
IUPAC Name2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide
SMILESCC(=O)NCC(=O)Nc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1
InChIInChI=1S/C12H18N4O6/c1-6(18)13-2-9(19)15-8-3-16(5-14-8)12-11(21)10(20)7(4-17)22-12/h3,5,7,10-12,17,20-21H,2,4H2,1H3,(H,13,18)(H,15,19)/t7-,10-,11-,12-/m1/s1
InChIKeyJGEZIOXIJODKPS-FAQVLOEFSA-N
XLogP-2.43
TPSA145.94 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.30
LogP ≤ 5-2.43
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Analyze 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide?
The IUPAC name of 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide (CID 11267003) is 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide.
What is the SMILES notation for 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide?
The canonical SMILES for 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide is CC(=O)NCC(=O)Nc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1.
What is the InChIKey of 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide?
The InChIKey is JGEZIOXIJODKPS-FAQVLOEFSA-N. The full InChI is InChI=1S/C12H18N4O6/c1-6(18)13-2-9(19)15-8-3-16(5-14-8)12-11(21)10(20)7(4-17)22-12/h3,5,7,10-12,17,20-21H,2,4H2,1H3,(H,13,18)(H,15,19)/t7-,10-,11-,12-/m1/s1.
What are the key properties of 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide?
2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide has a molecular weight of 314.30 g/mol, XLogP of -2.43, 5 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]imidazol-4-yl]acetamide is sourced from PubChem (CID 11267003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).