(E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine

C8H18N2 — CID 5365279

IUPAC(E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine
SMILESCN(C)C/C=C/CN(C)C
InChIInChI=1S/C8H18N2/c1-9(2)7-5-6-8-10(3)4/h5-6H,7-8H2,1-4H3/b6-5+
InChIKeyKUEDAAUECWBMLW-AATRIKPKSA-N
MW142.25 g/mol
LogP0.67
Rot. Bonds4

About (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine

(E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine (PubChem CID 5365279) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine.

Molecular Properties

Compound Name(E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine
PubChem CID5365279
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name(E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine
SMILESCN(C)C/C=C/CN(C)C
InChIInChI=1S/C8H18N2/c1-9(2)7-5-6-8-10(3)4/h5-6H,7-8H2,1-4H3/b6-5+
InChIKeyKUEDAAUECWBMLW-AATRIKPKSA-N
XLogP0.67
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine?
The IUPAC name of (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine (CID 5365279) is (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine.
What is the SMILES notation for (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine?
The canonical SMILES for (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine is CN(C)C/C=C/CN(C)C.
What is the InChIKey of (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine?
The InChIKey is KUEDAAUECWBMLW-AATRIKPKSA-N. The full InChI is InChI=1S/C8H18N2/c1-9(2)7-5-6-8-10(3)4/h5-6H,7-8H2,1-4H3/b6-5+.
What are the key properties of (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine?
(E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine has a molecular weight of 142.25 g/mol, XLogP of 0.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N,N',N'-tetramethylbut-2-ene-1,4-diamine is sourced from PubChem (CID 5365279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).