oct-4-ene-1,4,5,8-tetramine

C8H20N4 — CID 173366331

IUPACoct-4-ene-1,4,5,8-tetramine
SMILESNCCCC(N)=C(N)CCCN
InChIInChI=1S/C8H20N4/c9-5-1-3-7(11)8(12)4-2-6-10/h1-6,9-12H2
InChIKeyFEZGTFMGOIGUME-UHFFFAOYSA-N
MW172.28 g/mol
LogP-0.41
Rot. Bonds6

About oct-4-ene-1,4,5,8-tetramine

oct-4-ene-1,4,5,8-tetramine (PubChem CID 173366331) has the molecular formula C8H20N4 and a molecular weight of 172.28 g/mol. Its IUPAC name is oct-4-ene-1,4,5,8-tetramine.

Molecular Properties

Compound Nameoct-4-ene-1,4,5,8-tetramine
PubChem CID173366331
Molecular FormulaC8H20N4
Molecular Weight172.28 g/mol
Exact Mass172.17
IUPAC Nameoct-4-ene-1,4,5,8-tetramine
SMILESNCCCC(N)=C(N)CCCN
InChIInChI=1S/C8H20N4/c9-5-1-3-7(11)8(12)4-2-6-10/h1-6,9-12H2
InChIKeyFEZGTFMGOIGUME-UHFFFAOYSA-N
XLogP-0.41
TPSA104.08 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.28
LogP ≤ 5-0.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of oct-4-ene-1,4,5,8-tetramine?
The IUPAC name of oct-4-ene-1,4,5,8-tetramine (CID 173366331) is oct-4-ene-1,4,5,8-tetramine.
What is the SMILES notation for oct-4-ene-1,4,5,8-tetramine?
The canonical SMILES for oct-4-ene-1,4,5,8-tetramine is NCCCC(N)=C(N)CCCN.
What is the InChIKey of oct-4-ene-1,4,5,8-tetramine?
The InChIKey is FEZGTFMGOIGUME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N4/c9-5-1-3-7(11)8(12)4-2-6-10/h1-6,9-12H2.
What are the key properties of oct-4-ene-1,4,5,8-tetramine?
oct-4-ene-1,4,5,8-tetramine has a molecular weight of 172.28 g/mol, XLogP of -0.41, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oct-4-ene-1,4,5,8-tetramine is sourced from PubChem (CID 173366331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).