azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol

C10H25NO4 — CID 87459588

IUPACazane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol
SMILESCCCCC(O)COCCOCCO.N
InChIInChI=1S/C10H22O4.H3N/c1-2-3-4-10(12)9-14-8-7-13-6-5-11;/h10-12H,2-9H2,1H3;1H3
InChIKeyYADYADJSRXQVFD-UHFFFAOYSA-N
MW223.31 g/mol
LogP0.73
Rot. Bonds10

About azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol

azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol (PubChem CID 87459588) has the molecular formula C10H25NO4 and a molecular weight of 223.31 g/mol. Its IUPAC name is azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol.

Molecular Properties

Compound Nameazane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol
PubChem CID87459588
Molecular FormulaC10H25NO4
Molecular Weight223.31 g/mol
Exact Mass223.18
IUPAC Nameazane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol
SMILESCCCCC(O)COCCOCCO.N
InChIInChI=1S/C10H22O4.H3N/c1-2-3-4-10(12)9-14-8-7-13-6-5-11;/h10-12H,2-9H2,1H3;1H3
InChIKeyYADYADJSRXQVFD-UHFFFAOYSA-N
XLogP0.73
TPSA93.92 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.31
LogP ≤ 50.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]hexan-2-ol
CID 140523631
1-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]heptan-2-ol
CID 140523672
azane;1-[2-(2-hydroxyethoxy)ethoxy]tetradecan-2-ol;hydrate
CID 173484113
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]tetradecan-2-ol
CID 139267706
1,8-bis[2-(2-hydroxyethoxy)ethoxy]octane-2,7-diol
CID 142397445
acetic acid;1-(2-hydroxyethoxy)hexan-2-ol
CID 87319718
1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol;prop-2-enoic acid
CID 88661046
4-(2-butoxyethoxy)butane-1,3-diol
CID 174811578
disodium;1-[2-(2-hydroxyethoxy)ethoxy]tetradecan-2-ol;sulfate
CID 172848066
1-[2-(2-hydroxydodecoxy)ethoxy]dodecan-2-ol
CID 11796902
3-hexoxypropane-1,2-diol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 174323318
1-(2-butoxyethoxy)-4-[4-(2-butoxyethoxy)-3-hydroxybutoxy]butan-2-ol
CID 91607283

Frequently Asked Questions

What is the IUPAC name of azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol?
The IUPAC name of azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol (CID 87459588) is azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol.
What is the SMILES notation for azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol?
The canonical SMILES for azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol is CCCCC(O)COCCOCCO.N.
What is the InChIKey of azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol?
The InChIKey is YADYADJSRXQVFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4.H3N/c1-2-3-4-10(12)9-14-8-7-13-6-5-11;/h10-12H,2-9H2,1H3;1H3.
What are the key properties of azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol?
azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol has a molecular weight of 223.31 g/mol, XLogP of 0.73, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1-[2-(2-hydroxyethoxy)ethoxy]hexan-2-ol is sourced from PubChem (CID 87459588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).