methyl N-(2-hydroxyethyl)-N-methylcarbamate

C5H11NO3 — CID 568300

IUPACmethyl N-(2-hydroxyethyl)-N-methylcarbamate
SMILESCOC(=O)N(C)CCO
InChIInChI=1S/C5H11NO3/c1-6(3-4-7)5(8)9-2/h7H,3-4H2,1-2H3
InChIKeyGOPRQCGVIZIXTH-UHFFFAOYSA-N
MW133.15 g/mol
LogP-0.32
Rot. Bonds2

About methyl N-(2-hydroxyethyl)-N-methylcarbamate

methyl N-(2-hydroxyethyl)-N-methylcarbamate (PubChem CID 568300) has the molecular formula C5H11NO3 and a molecular weight of 133.15 g/mol. Its IUPAC name is methyl N-(2-hydroxyethyl)-N-methylcarbamate.

Molecular Properties

Compound Namemethyl N-(2-hydroxyethyl)-N-methylcarbamate
PubChem CID568300
Molecular FormulaC5H11NO3
Molecular Weight133.15 g/mol
Exact Mass133.07
IUPAC Namemethyl N-(2-hydroxyethyl)-N-methylcarbamate
SMILESCOC(=O)N(C)CCO
InChIInChI=1S/C5H11NO3/c1-6(3-4-7)5(8)9-2/h7H,3-4H2,1-2H3
InChIKeyGOPRQCGVIZIXTH-UHFFFAOYSA-N
XLogP-0.32
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.15
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl N-(2-hydroxyethyl)-N-methylcarbamate 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 methyl N-(2-hydroxyethyl)-N-methylcarbamate?
The IUPAC name of methyl N-(2-hydroxyethyl)-N-methylcarbamate (CID 568300) is methyl N-(2-hydroxyethyl)-N-methylcarbamate.
What is the SMILES notation for methyl N-(2-hydroxyethyl)-N-methylcarbamate?
The canonical SMILES for methyl N-(2-hydroxyethyl)-N-methylcarbamate is COC(=O)N(C)CCO.
What is the InChIKey of methyl N-(2-hydroxyethyl)-N-methylcarbamate?
The InChIKey is GOPRQCGVIZIXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO3/c1-6(3-4-7)5(8)9-2/h7H,3-4H2,1-2H3.
What are the key properties of methyl N-(2-hydroxyethyl)-N-methylcarbamate?
methyl N-(2-hydroxyethyl)-N-methylcarbamate has a molecular weight of 133.15 g/mol, XLogP of -0.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(2-hydroxyethyl)-N-methylcarbamate is sourced from PubChem (CID 568300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).