oxetan-2-yl N,N-dimethylcarbamate

C6H11NO3 — CID 91169743

IUPACoxetan-2-yl N,N-dimethylcarbamate
SMILESCN(C)C(=O)OC1CCO1
InChIInChI=1S/C6H11NO3/c1-7(2)6(8)10-5-3-4-9-5/h5H,3-4H2,1-2H3
InChIKeyASTSFDURZRRBMR-UHFFFAOYSA-N
MW145.16 g/mol
LogP0.43
Rot. Bonds1

About oxetan-2-yl N,N-dimethylcarbamate

oxetan-2-yl N,N-dimethylcarbamate (PubChem CID 91169743) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is oxetan-2-yl N,N-dimethylcarbamate.

Molecular Properties

Compound Nameoxetan-2-yl N,N-dimethylcarbamate
PubChem CID91169743
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC Nameoxetan-2-yl N,N-dimethylcarbamate
SMILESCN(C)C(=O)OC1CCO1
InChIInChI=1S/C6H11NO3/c1-7(2)6(8)10-5-3-4-9-5/h5H,3-4H2,1-2H3
InChIKeyASTSFDURZRRBMR-UHFFFAOYSA-N
XLogP0.43
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

oxetan-2-yl N-methylcarbamate
CID 20764471
1-methoxyethyl N,N-dimethylcarbamate
CID 87292048
oxetan-2-yl N,N-diethylcarbamate
CID 91391054
1-Ethoxyethyl dimethylcarbamate
CID 12388055

Frequently Asked Questions

What is the IUPAC name of oxetan-2-yl N,N-dimethylcarbamate?
The IUPAC name of oxetan-2-yl N,N-dimethylcarbamate (CID 91169743) is oxetan-2-yl N,N-dimethylcarbamate.
What is the SMILES notation for oxetan-2-yl N,N-dimethylcarbamate?
The canonical SMILES for oxetan-2-yl N,N-dimethylcarbamate is CN(C)C(=O)OC1CCO1.
What is the InChIKey of oxetan-2-yl N,N-dimethylcarbamate?
The InChIKey is ASTSFDURZRRBMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c1-7(2)6(8)10-5-3-4-9-5/h5H,3-4H2,1-2H3.
What are the key properties of oxetan-2-yl N,N-dimethylcarbamate?
oxetan-2-yl N,N-dimethylcarbamate has a molecular weight of 145.16 g/mol, XLogP of 0.43, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxetan-2-yl N,N-dimethylcarbamate is sourced from PubChem (CID 91169743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).