ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol

C11H25NO6 — CID 163439656

IUPACethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
SMILESCCNC(=O)OCC.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C5H11NO2/c7-1-3-9-5-6-10-4-2-8;1-3-6-5(7)8-4-2/h7-8H,1-6H2;3-4H2,1-2H3,(H,6,7)
InChIKeyAXKXNLUZMVSBSF-UHFFFAOYSA-N
MW267.32 g/mol
LogP-0.24
Rot. Bonds9

About ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol

ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol (PubChem CID 163439656) has the molecular formula C11H25NO6 and a molecular weight of 267.32 g/mol. Its IUPAC name is ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol.

Molecular Properties

Compound Nameethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
PubChem CID163439656
Molecular FormulaC11H25NO6
Molecular Weight267.32 g/mol
Exact Mass267.17
IUPAC Nameethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
SMILESCCNC(=O)OCC.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C5H11NO2/c7-1-3-9-5-6-10-4-2-8;1-3-6-5(7)8-4-2/h7-8H,1-6H2;3-4H2,1-2H3,(H,6,7)
InChIKeyAXKXNLUZMVSBSF-UHFFFAOYSA-N
XLogP-0.24
TPSA97.25 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 5-0.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

azane;ethyl N-ethylcarbamate
CID 88547448
ethane;N-ethyl-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]acetamide
CID 167443378
N-ethyl-3-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanamide
CID 164717500
N-ethyl-2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]acetamide
CID 167443379
ethane;ethyl N-(2-propoxyethyl)carbamate
CID 167457488
ethyl 2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91696590
diethyl carbonate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-methoxy-2-(2-methoxyethoxy)ethane
CID 174866576
2-(2-hydroxyethoxy)ethyl N-octadecylcarbamate
CID 14782678
2-(2-ethoxyethoxy)ethanol;propan-2-one
CID 158361782
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethyl N-(3-triethoxysilylpropyl)carbamate
CID 102138334
ethyl 3-(2-hydroxyethoxy)propanoate
CID 22394031
2-hydroxyethyl N-(3-propoxypropyl)carbamate
CID 82947518

Frequently Asked Questions

What is the IUPAC name of ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
The IUPAC name of ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol (CID 163439656) is ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol.
What is the SMILES notation for ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
The canonical SMILES for ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol is CCNC(=O)OCC.OCCOCCOCCO.
What is the InChIKey of ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
The InChIKey is AXKXNLUZMVSBSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.C5H11NO2/c7-1-3-9-5-6-10-4-2-8;1-3-6-5(7)8-4-2/h7-8H,1-6H2;3-4H2,1-2H3,(H,6,7).
What are the key properties of ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol?
ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol has a molecular weight of 267.32 g/mol, XLogP of -0.24, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-ethylcarbamate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 163439656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).