N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide

C7H12N2O3 — CID 143626147

IUPACN-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide
SMILESCC(=O)NCC1COC(=O)N1C
InChIInChI=1S/C7H12N2O3/c1-5(10)8-3-6-4-12-7(11)9(6)2/h6H,3-4H2,1-2H3,(H,8,10)
InChIKeyMNGRTRUXGITHIZ-UHFFFAOYSA-N
MW172.18 g/mol
LogP-0.43
Rot. Bonds2

About N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide

N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide (PubChem CID 143626147) has the molecular formula C7H12N2O3 and a molecular weight of 172.18 g/mol. Its IUPAC name is N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide
PubChem CID143626147
Molecular FormulaC7H12N2O3
Molecular Weight172.18 g/mol
Exact Mass172.08
IUPAC NameN-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide
SMILESCC(=O)NCC1COC(=O)N1C
InChIInChI=1S/C7H12N2O3/c1-5(10)8-3-6-4-12-7(11)9(6)2/h6H,3-4H2,1-2H3,(H,8,10)
InChIKeyMNGRTRUXGITHIZ-UHFFFAOYSA-N
XLogP-0.43
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.18
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide?
The IUPAC name of N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide (CID 143626147) is N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide.
What is the SMILES notation for N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide?
The canonical SMILES for N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide is CC(=O)NCC1COC(=O)N1C.
What is the InChIKey of N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide?
The InChIKey is MNGRTRUXGITHIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3/c1-5(10)8-3-6-4-12-7(11)9(6)2/h6H,3-4H2,1-2H3,(H,8,10).
What are the key properties of N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide?
N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide has a molecular weight of 172.18 g/mol, XLogP of -0.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-2-oxo-1,3-oxazolidin-4-yl)methyl]acetamide is sourced from PubChem (CID 143626147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).