(Z)-2-ethylprop-1-ene-1,3-diamine

C5H12N2 — CID 87664762

IUPAC(Z)-2-ethylprop-1-ene-1,3-diamine
SMILESCC/C(=C/N)CN
InChIInChI=1S/C5H12N2/c1-2-5(3-6)4-7/h3H,2,4,6-7H2,1H3/b5-3-
InChIKeyRGPFSFPLPVRIDP-HYXAFXHYSA-N
MW100.16 g/mol
LogP0.20
Rot. Bonds2

About (Z)-2-ethylprop-1-ene-1,3-diamine

(Z)-2-ethylprop-1-ene-1,3-diamine (PubChem CID 87664762) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is (Z)-2-ethylprop-1-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-2-ethylprop-1-ene-1,3-diamine
PubChem CID87664762
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Name(Z)-2-ethylprop-1-ene-1,3-diamine
SMILESCC/C(=C/N)CN
InChIInChI=1S/C5H12N2/c1-2-5(3-6)4-7/h3H,2,4,6-7H2,1H3/b5-3-
InChIKeyRGPFSFPLPVRIDP-HYXAFXHYSA-N
XLogP0.20
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-ethylprop-1-ene-1,3-diamine?
The IUPAC name of (Z)-2-ethylprop-1-ene-1,3-diamine (CID 87664762) is (Z)-2-ethylprop-1-ene-1,3-diamine.
What is the SMILES notation for (Z)-2-ethylprop-1-ene-1,3-diamine?
The canonical SMILES for (Z)-2-ethylprop-1-ene-1,3-diamine is CC/C(=C/N)CN.
What is the InChIKey of (Z)-2-ethylprop-1-ene-1,3-diamine?
The InChIKey is RGPFSFPLPVRIDP-HYXAFXHYSA-N. The full InChI is InChI=1S/C5H12N2/c1-2-5(3-6)4-7/h3H,2,4,6-7H2,1H3/b5-3-.
What are the key properties of (Z)-2-ethylprop-1-ene-1,3-diamine?
(Z)-2-ethylprop-1-ene-1,3-diamine has a molecular weight of 100.16 g/mol, XLogP of 0.20, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-ethylprop-1-ene-1,3-diamine is sourced from PubChem (CID 87664762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).