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

C6H14N2 — CID 118478901

IUPAC(Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine
SMILESCC/C(=C/NC)CN
InChIInChI=1S/C6H14N2/c1-3-6(4-7)5-8-2/h5,8H,3-4,7H2,1-2H3/b6-5-
InChIKeyAGEMTIURSGGUCR-WAYWQWQTSA-N
MW114.19 g/mol
LogP0.46
Rot. Bonds3

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

(Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine (PubChem CID 118478901) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine
PubChem CID118478901
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name(Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine
SMILESCC/C(=C/NC)CN
InChIInChI=1S/C6H14N2/c1-3-6(4-7)5-8-2/h5,8H,3-4,7H2,1-2H3/b6-5-
InChIKeyAGEMTIURSGGUCR-WAYWQWQTSA-N
XLogP0.46
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine?
The IUPAC name of (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine (CID 118478901) is (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine.
What is the SMILES notation for (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine?
The canonical SMILES for (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine is CC/C(=C/NC)CN.
What is the InChIKey of (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine?
The InChIKey is AGEMTIURSGGUCR-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H14N2/c1-3-6(4-7)5-8-2/h5,8H,3-4,7H2,1-2H3/b6-5-.
What are the key properties of (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine?
(Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine has a molecular weight of 114.19 g/mol, XLogP of 0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethyl-N-methylprop-1-ene-1,3-diamine is sourced from PubChem (CID 118478901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).