2-[2-(3-propoxypropylamino)ethoxy]ethanol

C10H23NO3 — CID 82944061

IUPAC2-[2-(3-propoxypropylamino)ethoxy]ethanol
SMILESCCCOCCCNCCOCCO
InChIInChI=1S/C10H23NO3/c1-2-7-13-8-3-4-11-5-9-14-10-6-12/h11-12H,2-10H2,1H3
InChIKeyRQYLURQRPGWAMD-UHFFFAOYSA-N
MW205.30 g/mol
LogP0.40
Rot. Bonds11

About 2-[2-(3-propoxypropylamino)ethoxy]ethanol

2-[2-(3-propoxypropylamino)ethoxy]ethanol (PubChem CID 82944061) has the molecular formula C10H23NO3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-[2-(3-propoxypropylamino)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(3-propoxypropylamino)ethoxy]ethanol
PubChem CID82944061
Molecular FormulaC10H23NO3
Molecular Weight205.30 g/mol
Exact Mass205.17
IUPAC Name2-[2-(3-propoxypropylamino)ethoxy]ethanol
SMILESCCCOCCCNCCOCCO
InChIInChI=1S/C10H23NO3/c1-2-7-13-8-3-4-11-5-9-14-10-6-12/h11-12H,2-10H2,1H3
InChIKeyRQYLURQRPGWAMD-UHFFFAOYSA-N
XLogP0.40
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(2-propoxyethylamino)propoxy]ethanol
CID 106310032
2-[2-(heptylamino)ethoxy]ethanol
CID 4712323
2-[2-(dodecylamino)ethoxy]ethanol
CID 4546884
2-(4-propoxybutoxy)-N-[2-(4-propoxybutoxy)ethyl]ethanamine
CID 87914124
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(hexadecylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 101188232
acetic acid;2-[2-(3-dodecoxypropylamino)ethoxy]ethanol
CID 170851878
2-[2-[2-[2-[2-[2-(propylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 156860733
3-[3-(2-hydroxyethoxy)propylamino]propan-1-ol
CID 106309635
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594890
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594464
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethylamino]ethoxy]ethoxy]ethoxy]ethanol
CID 123132110
4-[2-(propylamino)ethoxy]butan-1-ol
CID 106937948

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-propoxypropylamino)ethoxy]ethanol?
The IUPAC name of 2-[2-(3-propoxypropylamino)ethoxy]ethanol (CID 82944061) is 2-[2-(3-propoxypropylamino)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(3-propoxypropylamino)ethoxy]ethanol?
The canonical SMILES for 2-[2-(3-propoxypropylamino)ethoxy]ethanol is CCCOCCCNCCOCCO.
What is the InChIKey of 2-[2-(3-propoxypropylamino)ethoxy]ethanol?
The InChIKey is RQYLURQRPGWAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO3/c1-2-7-13-8-3-4-11-5-9-14-10-6-12/h11-12H,2-10H2,1H3.
What are the key properties of 2-[2-(3-propoxypropylamino)ethoxy]ethanol?
2-[2-(3-propoxypropylamino)ethoxy]ethanol has a molecular weight of 205.30 g/mol, XLogP of 0.40, 11 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-propoxypropylamino)ethoxy]ethanol is sourced from PubChem (CID 82944061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).