(Z)-pent-2-ene-2,4-diamine

C5H12N2 — CID 118680206

IUPAC(Z)-pent-2-ene-2,4-diamine
SMILESC/C(N)=C/C(C)N
InChIInChI=1S/C5H12N2/c1-4(6)3-5(2)7/h3-4H,6-7H2,1-2H3/b5-3-
InChIKeyXJSVNQCGIOEPGP-HYXAFXHYSA-N
MW100.17 g/mol
LogP0.20
Rot. Bonds1

About (Z)-pent-2-ene-2,4-diamine

(Z)-pent-2-ene-2,4-diamine (PubChem CID 118680206) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is (Z)-pent-2-ene-2,4-diamine.

Molecular Properties

Compound Name(Z)-pent-2-ene-2,4-diamine
PubChem CID118680206
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name(Z)-pent-2-ene-2,4-diamine
SMILESC/C(N)=C/C(C)N
InChIInChI=1S/C5H12N2/c1-4(6)3-5(2)7/h3-4H,6-7H2,1-2H3/b5-3-
InChIKeyXJSVNQCGIOEPGP-HYXAFXHYSA-N
XLogP0.20
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
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)-pent-2-ene-2,4-diamine?
The IUPAC name of (Z)-pent-2-ene-2,4-diamine (CID 118680206) is (Z)-pent-2-ene-2,4-diamine.
What is the SMILES notation for (Z)-pent-2-ene-2,4-diamine?
The canonical SMILES for (Z)-pent-2-ene-2,4-diamine is C/C(N)=C/C(C)N.
What is the InChIKey of (Z)-pent-2-ene-2,4-diamine?
The InChIKey is XJSVNQCGIOEPGP-HYXAFXHYSA-N. The full InChI is InChI=1S/C5H12N2/c1-4(6)3-5(2)7/h3-4H,6-7H2,1-2H3/b5-3-.
What are the key properties of (Z)-pent-2-ene-2,4-diamine?
(Z)-pent-2-ene-2,4-diamine has a molecular weight of 100.17 g/mol, XLogP of 0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-pent-2-ene-2,4-diamine is sourced from PubChem (CID 118680206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).