2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate

C9H20N2O5 — CID 118597467

IUPAC2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate
SMILESNCCOCCOCCOCCOC(N)=O
InChIInChI=1S/C9H20N2O5/c10-1-2-13-3-4-14-5-6-15-7-8-16-9(11)12/h1-8,10H2,(H2,11,12)
InChIKeyDZOBCUOPTRNDEJ-UHFFFAOYSA-N
MW236.27 g/mol
LogP-0.91
Rot. Bonds11

About 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate

2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate (PubChem CID 118597467) has the molecular formula C9H20N2O5 and a molecular weight of 236.27 g/mol. Its IUPAC name is 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate.

Molecular Properties

Compound Name2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate
PubChem CID118597467
Molecular FormulaC9H20N2O5
Molecular Weight236.27 g/mol
Exact Mass236.14
IUPAC Name2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate
SMILESNCCOCCOCCOCCOC(N)=O
InChIInChI=1S/C9H20N2O5/c10-1-2-13-3-4-14-5-6-15-7-8-16-9(11)12/h1-8,10H2,(H2,11,12)
InChIKeyDZOBCUOPTRNDEJ-UHFFFAOYSA-N
XLogP-0.91
TPSA106.03 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-aminoethoxy)ethoxy]ethanamine;butanediamide
CID 87072841
2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethyl carbamate
CID 170160421
2-[2-(2-propoxyethoxy)ethoxy]ethyl carbamate
CID 177163981
9-aminononyl carbamate
CID 87884060
2-[2-(2-oxoethoxy)ethoxy]ethyl carbamate
CID 89498501
2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanamine;azane
CID 174533279
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetic acid
CID 155415114
3-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 122361149
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 119058379
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
CID 53433573
2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethyl carbamate
CID 175090580
9-carbamoyloxynonyl carbamate
CID 87883969

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate?
The IUPAC name of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate (CID 118597467) is 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate.
What is the SMILES notation for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate?
The canonical SMILES for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate is NCCOCCOCCOCCOC(N)=O.
What is the InChIKey of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate?
The InChIKey is DZOBCUOPTRNDEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O5/c10-1-2-13-3-4-14-5-6-15-7-8-16-9(11)12/h1-8,10H2,(H2,11,12).
What are the key properties of 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate?
2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate has a molecular weight of 236.27 g/mol, XLogP of -0.91, 11 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethyl carbamate is sourced from PubChem (CID 118597467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).