2-N,3-N-dimethylbut-2-ene-2,3-diamine

C6H14N2 — CID 72660473

IUPAC2-N,3-N-dimethylbut-2-ene-2,3-diamine
SMILESCNC(C)=C(C)NC
InChIInChI=1S/C6H14N2/c1-5(7-3)6(2)8-4/h7-8H,1-4H3
InChIKeyLFKWHOQWJZCJAT-UHFFFAOYSA-N
MW114.19 g/mol
LogP0.68
Rot. Bonds2

About 2-N,3-N-dimethylbut-2-ene-2,3-diamine

2-N,3-N-dimethylbut-2-ene-2,3-diamine (PubChem CID 72660473) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is 2-N,3-N-dimethylbut-2-ene-2,3-diamine.

Molecular Properties

Compound Name2-N,3-N-dimethylbut-2-ene-2,3-diamine
PubChem CID72660473
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name2-N,3-N-dimethylbut-2-ene-2,3-diamine
SMILESCNC(C)=C(C)NC
InChIInChI=1S/C6H14N2/c1-5(7-3)6(2)8-4/h7-8H,1-4H3
InChIKeyLFKWHOQWJZCJAT-UHFFFAOYSA-N
XLogP0.68
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-N,3-N-dimethylbut-2-ene-2,3-diamine?
The IUPAC name of 2-N,3-N-dimethylbut-2-ene-2,3-diamine (CID 72660473) is 2-N,3-N-dimethylbut-2-ene-2,3-diamine.
What is the SMILES notation for 2-N,3-N-dimethylbut-2-ene-2,3-diamine?
The canonical SMILES for 2-N,3-N-dimethylbut-2-ene-2,3-diamine is CNC(C)=C(C)NC.
What is the InChIKey of 2-N,3-N-dimethylbut-2-ene-2,3-diamine?
The InChIKey is LFKWHOQWJZCJAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-5(7-3)6(2)8-4/h7-8H,1-4H3.
What are the key properties of 2-N,3-N-dimethylbut-2-ene-2,3-diamine?
2-N,3-N-dimethylbut-2-ene-2,3-diamine has a molecular weight of 114.19 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,3-N-dimethylbut-2-ene-2,3-diamine is sourced from PubChem (CID 72660473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).