(Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine

C7H16N2 — CID 163865379

IUPAC(Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine
SMILESCCN/C=C(/C)CNC
InChIInChI=1S/C7H16N2/c1-4-9-6-7(2)5-8-3/h6,8-9H,4-5H2,1-3H3/b7-6-
InChIKeyPGEFNOALTCYLKO-SREVYHEPSA-N
MW128.22 g/mol
LogP0.72
Rot. Bonds4

About (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine

(Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine (PubChem CID 163865379) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine
PubChem CID163865379
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name(Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine
SMILESCCN/C=C(/C)CNC
InChIInChI=1S/C7H16N2/c1-4-9-6-7(2)5-8-3/h6,8-9H,4-5H2,1-3H3/b7-6-
InChIKeyPGEFNOALTCYLKO-SREVYHEPSA-N
XLogP0.72
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine?
The IUPAC name of (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine (CID 163865379) is (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine.
What is the SMILES notation for (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine?
The canonical SMILES for (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine is CCN/C=C(/C)CNC.
What is the InChIKey of (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine?
The InChIKey is PGEFNOALTCYLKO-SREVYHEPSA-N. The full InChI is InChI=1S/C7H16N2/c1-4-9-6-7(2)5-8-3/h6,8-9H,4-5H2,1-3H3/b7-6-.
What are the key properties of (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine?
(Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine has a molecular weight of 128.22 g/mol, XLogP of 0.72, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-ethyl-N',2-dimethylprop-1-ene-1,3-diamine is sourced from PubChem (CID 163865379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).