2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide

C13H20N2O3 — CID 129003376

IUPAC2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide
SMILESCC(C)[C@H]1OCC[C@@H]1CNC(=O)Cc1ccon1
InChIInChI=1S/C13H20N2O3/c1-9(2)13-10(3-5-17-13)8-14-12(16)7-11-4-6-18-15-11/h4,6,9-10,13H,3,5,7-8H2,1-2H3,(H,14,16)/t10-,13-/m1/s1
InChIKeyQWIIAMGOMSLTEJ-ZWNOBZJWSA-N
MW252.31 g/mol
LogP1.39
Rot. Bonds5

About 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide

2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide (PubChem CID 129003376) has the molecular formula C13H20N2O3 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide.

Molecular Properties

Compound Name2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide
PubChem CID129003376
Molecular FormulaC13H20N2O3
Molecular Weight252.31 g/mol
Exact Mass252.15
IUPAC Name2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide
SMILESCC(C)[C@H]1OCC[C@@H]1CNC(=O)Cc1ccon1
InChIInChI=1S/C13H20N2O3/c1-9(2)13-10(3-5-17-13)8-14-12(16)7-11-4-6-18-15-11/h4,6,9-10,13H,3,5,7-8H2,1-2H3,(H,14,16)/t10-,13-/m1/s1
InChIKeyQWIIAMGOMSLTEJ-ZWNOBZJWSA-N
XLogP1.39
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide with MolForge

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Related Compounds

2-(1,2-oxazol-3-yl)-N-[[(2S,3R)-2-phenyloxolan-3-yl]methyl]acetamide
CID 129002650
2-(1-methylpyrazol-4-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide
CID 129003467
N-[[(2S,3R)-2-propan-2-yloxolan-3-yl]methyl]-1H-pyrazole-5-carboxamide
CID 95973460
4-(aminomethyl)-N-[(2-propan-2-yloxolan-3-yl)methyl]benzamide;hydrochloride
CID 119343856
N-[2-oxo-2-[[(2S,3S)-2-propan-2-yloxolan-3-yl]methylamino]ethyl]thiophene-2-carboxamide
CID 96528902
3-methoxy-N-[[(2R,3S)-2-propan-2-yloxolan-3-yl]methyl]-1,2-oxazole-5-carboxamide
CID 97351811
2,4-dimethyl-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]-1,3-oxazole-5-carboxamide
CID 100638775
2-amino-N-[(2-propan-2-yloxolan-3-yl)methyl]propanamide
CID 119343855
2-(5-fluoro-2-methoxyphenyl)-N-[[(2S,3S)-2-propan-2-yloxan-3-yl]methyl]acetamide
CID 129399228
2-(5-fluoro-2-methoxyphenyl)-N-[[(2R,3S)-2-propan-2-yloxan-3-yl]methyl]acetamide
CID 129399227
2-(5-fluoro-2-methoxyphenyl)-N-[[(2S,3R)-2-propan-2-yloxan-3-yl]methyl]acetamide
CID 129399230
N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]-4H-furo[3,2-b]pyrrole-5-carboxamide
CID 129000650

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide?
The IUPAC name of 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide (CID 129003376) is 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide.
What is the SMILES notation for 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide?
The canonical SMILES for 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide is CC(C)[C@H]1OCC[C@@H]1CNC(=O)Cc1ccon1.
What is the InChIKey of 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide?
The InChIKey is QWIIAMGOMSLTEJ-ZWNOBZJWSA-N. The full InChI is InChI=1S/C13H20N2O3/c1-9(2)13-10(3-5-17-13)8-14-12(16)7-11-4-6-18-15-11/h4,6,9-10,13H,3,5,7-8H2,1-2H3,(H,14,16)/t10-,13-/m1/s1.
What are the key properties of 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide?
2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide has a molecular weight of 252.31 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-oxazol-3-yl)-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]acetamide is sourced from PubChem (CID 129003376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).