1-(6-ethoxyhexoxy)ethane-1,2-diamine

C10H24N2O2 — CID 87666943

IUPAC1-(6-ethoxyhexoxy)ethane-1,2-diamine
SMILESCCOCCCCCCOC(N)CN
InChIInChI=1S/C10H24N2O2/c1-2-13-7-5-3-4-6-8-14-10(12)9-11/h10H,2-9,11-12H2,1H3
InChIKeyOWBCZOVHTZTAOY-UHFFFAOYSA-N
MW204.31 g/mol
LogP0.84
Rot. Bonds10

About 1-(6-ethoxyhexoxy)ethane-1,2-diamine

1-(6-ethoxyhexoxy)ethane-1,2-diamine (PubChem CID 87666943) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-(6-ethoxyhexoxy)ethane-1,2-diamine.

Molecular Properties

Compound Name1-(6-ethoxyhexoxy)ethane-1,2-diamine
PubChem CID87666943
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC Name1-(6-ethoxyhexoxy)ethane-1,2-diamine
SMILESCCOCCCCCCOC(N)CN
InChIInChI=1S/C10H24N2O2/c1-2-13-7-5-3-4-6-8-14-10(12)9-11/h10H,2-9,11-12H2,1H3
InChIKeyOWBCZOVHTZTAOY-UHFFFAOYSA-N
XLogP0.84
TPSA70.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-[4-(3-aminopropoxy)butoxy]propan-1-amine
CID 22758954
4-ethoxybutoxymethanamine
CID 87914089
4-ethoxybutan-1-amine;hydrochloride
CID 87771260
3-(4-ethoxybutoxy)propan-1-amine
CID 87914179
1-ethoxy-14-(8-fluorooctoxy)tetradecane
CID 139714700
3-octadecoxy-2-tetradecoxypropan-1-amine
CID 10209091
2-hexadecoxy-3-tetradecoxypropan-1-amine
CID 11827343
2-dodecoxy-3-hexadecoxypropan-1-amine
CID 10299682
1-tetradecoxypropan-1-amine;hydrobromide
CID 173193932
4-ethoxybutoxymethanethiol
CID 87914042
1-ethoxy-17-methyloctadecane
CID 91042875
8-ethoxyoctyl(dimethyl)silane
CID 172779894

Frequently Asked Questions

What is the IUPAC name of 1-(6-ethoxyhexoxy)ethane-1,2-diamine?
The IUPAC name of 1-(6-ethoxyhexoxy)ethane-1,2-diamine (CID 87666943) is 1-(6-ethoxyhexoxy)ethane-1,2-diamine.
What is the SMILES notation for 1-(6-ethoxyhexoxy)ethane-1,2-diamine?
The canonical SMILES for 1-(6-ethoxyhexoxy)ethane-1,2-diamine is CCOCCCCCCOC(N)CN.
What is the InChIKey of 1-(6-ethoxyhexoxy)ethane-1,2-diamine?
The InChIKey is OWBCZOVHTZTAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-2-13-7-5-3-4-6-8-14-10(12)9-11/h10H,2-9,11-12H2,1H3.
What are the key properties of 1-(6-ethoxyhexoxy)ethane-1,2-diamine?
1-(6-ethoxyhexoxy)ethane-1,2-diamine has a molecular weight of 204.31 g/mol, XLogP of 0.84, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-ethoxyhexoxy)ethane-1,2-diamine is sourced from PubChem (CID 87666943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).