7-ethoxy-3-ethyldecan-3-amine

C14H31NO — CID 57119536

IUPAC7-ethoxy-3-ethyldecan-3-amine
SMILESCCCC(CCCC(N)(CC)CC)OCC
InChIInChI=1S/C14H31NO/c1-5-10-13(16-8-4)11-9-12-14(15,6-2)7-3/h13H,5-12,15H2,1-4H3
InChIKeySTRXDLYEIDJOFZ-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.88
Rot. Bonds10

About 7-ethoxy-3-ethyldecan-3-amine

7-ethoxy-3-ethyldecan-3-amine (PubChem CID 57119536) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 7-ethoxy-3-ethyldecan-3-amine.

Molecular Properties

Compound Name7-ethoxy-3-ethyldecan-3-amine
PubChem CID57119536
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name7-ethoxy-3-ethyldecan-3-amine
SMILESCCCC(CCCC(N)(CC)CC)OCC
InChIInChI=1S/C14H31NO/c1-5-10-13(16-8-4)11-9-12-14(15,6-2)7-3/h13H,5-12,15H2,1-4H3
InChIKeySTRXDLYEIDJOFZ-UHFFFAOYSA-N
XLogP3.88
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-ethoxy-3-ethyldecan-3-amine?
The IUPAC name of 7-ethoxy-3-ethyldecan-3-amine (CID 57119536) is 7-ethoxy-3-ethyldecan-3-amine.
What is the SMILES notation for 7-ethoxy-3-ethyldecan-3-amine?
The canonical SMILES for 7-ethoxy-3-ethyldecan-3-amine is CCCC(CCCC(N)(CC)CC)OCC.
What is the InChIKey of 7-ethoxy-3-ethyldecan-3-amine?
The InChIKey is STRXDLYEIDJOFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-5-10-13(16-8-4)11-9-12-14(15,6-2)7-3/h13H,5-12,15H2,1-4H3.
What are the key properties of 7-ethoxy-3-ethyldecan-3-amine?
7-ethoxy-3-ethyldecan-3-amine has a molecular weight of 229.41 g/mol, XLogP of 3.88, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethoxy-3-ethyldecan-3-amine is sourced from PubChem (CID 57119536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).