(E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine

C8H16N2 — CID 134603362

IUPAC(E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine
SMILESC=CN(CC)/C(C)=C/NC
InChIInChI=1S/C8H16N2/c1-5-10(6-2)8(3)7-9-4/h5,7,9H,1,6H2,2-4H3/b8-7+
InChIKeyGCWSZMDBDWCJTJ-BQYQJAHWSA-N
MW140.23 g/mol
LogP1.53
Rot. Bonds4

About (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine

(E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine (PubChem CID 134603362) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine.

Molecular Properties

Compound Name(E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine
PubChem CID134603362
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine
SMILESC=CN(CC)/C(C)=C/NC
InChIInChI=1S/C8H16N2/c1-5-10(6-2)8(3)7-9-4/h5,7,9H,1,6H2,2-4H3/b8-7+
InChIKeyGCWSZMDBDWCJTJ-BQYQJAHWSA-N
XLogP1.53
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine?
The IUPAC name of (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine (CID 134603362) is (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine.
What is the SMILES notation for (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine?
The canonical SMILES for (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine is C=CN(CC)/C(C)=C/NC.
What is the InChIKey of (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine?
The InChIKey is GCWSZMDBDWCJTJ-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H16N2/c1-5-10(6-2)8(3)7-9-4/h5,7,9H,1,6H2,2-4H3/b8-7+.
What are the key properties of (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine?
(E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine has a molecular weight of 140.23 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-N-ethenyl-2-N-ethyl-1-N-methylprop-1-ene-1,2-diamine is sourced from PubChem (CID 134603362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).