ethyl N-(2-hydroxyethyl)-N-methylcarbamate

C6H13NO3 — CID 19370355

IUPACethyl N-(2-hydroxyethyl)-N-methylcarbamate
SMILESCCOC(=O)N(C)CCO
InChIInChI=1S/C6H13NO3/c1-3-10-6(9)7(2)4-5-8/h8H,3-5H2,1-2H3
InChIKeyQVJUOHQGPAMHNX-UHFFFAOYSA-N
MW147.17 g/mol
LogP0.07
Rot. Bonds3

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

ethyl N-(2-hydroxyethyl)-N-methylcarbamate (PubChem CID 19370355) has the molecular formula C6H13NO3 and a molecular weight of 147.17 g/mol. Its IUPAC name is ethyl N-(2-hydroxyethyl)-N-methylcarbamate.

Molecular Properties

Compound Nameethyl N-(2-hydroxyethyl)-N-methylcarbamate
PubChem CID19370355
Molecular FormulaC6H13NO3
Molecular Weight147.17 g/mol
Exact Mass147.09
IUPAC Nameethyl N-(2-hydroxyethyl)-N-methylcarbamate
SMILESCCOC(=O)N(C)CCO
InChIInChI=1S/C6H13NO3/c1-3-10-6(9)7(2)4-5-8/h8H,3-5H2,1-2H3
InChIKeyQVJUOHQGPAMHNX-UHFFFAOYSA-N
XLogP0.07
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.17
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Oxazolidinone, 3-(2-hydroxyethyl)-
CID 76887
N-(tert-Butoxycarbonyl)-N-methyl-2-aminoethanol
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methyl N-(2-hydroxyethyl)-N-methylcarbamate
CID 568300
N-(2-Hydroxyethyl)-N-methylformamide
CID 74120
2-hydroxyethyl N-ethyl-N-methylcarbamate
CID 19833956
methyl N-(2-methoxyethyl)-N-methylcarbamate
CID 87169869
Carbamic acid, ethylmethyl-, ethyl ester
CID 20062878
Bis(2-hydroxyethyl) carbamic acid
CID 15795359
Formyl-(2-hydroxyethyl)-dimethylazanium
CID 20084581
trifluoromethyl N-(2-hydroxyethyl)-N-methylcarbamate
CID 141317064
2,2-difluoroethyl N-(2-hydroxyethyl)-N-methylcarbamate
CID 150421564
methyl N-fluoro-N-(2-hydroxyethyl)carbamate
CID 154965038

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-hydroxyethyl)-N-methylcarbamate?
The IUPAC name of ethyl N-(2-hydroxyethyl)-N-methylcarbamate (CID 19370355) is ethyl N-(2-hydroxyethyl)-N-methylcarbamate.
What is the SMILES notation for ethyl N-(2-hydroxyethyl)-N-methylcarbamate?
The canonical SMILES for ethyl N-(2-hydroxyethyl)-N-methylcarbamate is CCOC(=O)N(C)CCO.
What is the InChIKey of ethyl N-(2-hydroxyethyl)-N-methylcarbamate?
The InChIKey is QVJUOHQGPAMHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO3/c1-3-10-6(9)7(2)4-5-8/h8H,3-5H2,1-2H3.
What are the key properties of ethyl N-(2-hydroxyethyl)-N-methylcarbamate?
ethyl N-(2-hydroxyethyl)-N-methylcarbamate has a molecular weight of 147.17 g/mol, XLogP of 0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-hydroxyethyl)-N-methylcarbamate is sourced from PubChem (CID 19370355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).