(Z)-4-aminopent-3-enenitrile

C5H8N2 — CID 55289579

IUPAC(Z)-4-aminopent-3-enenitrile
SMILESC/C(N)=C/CC#N
InChIInChI=1S/C5H8N2/c1-5(7)3-2-4-6/h3H,2,7H2,1H3/b5-3-
InChIKeyXGJMFIZITROKBP-HYXAFXHYSA-N
MW96.13 g/mol
LogP0.76
Rot. Bonds1

About (Z)-4-aminopent-3-enenitrile

(Z)-4-aminopent-3-enenitrile (PubChem CID 55289579) has the molecular formula C5H8N2 and a molecular weight of 96.13 g/mol. Its IUPAC name is (Z)-4-aminopent-3-enenitrile.

Molecular Properties

Compound Name(Z)-4-aminopent-3-enenitrile
PubChem CID55289579
Molecular FormulaC5H8N2
Molecular Weight96.13 g/mol
Exact Mass96.07
IUPAC Name(Z)-4-aminopent-3-enenitrile
SMILESC/C(N)=C/CC#N
InChIInChI=1S/C5H8N2/c1-5(7)3-2-4-6/h3H,2,7H2,1H3/b5-3-
InChIKeyXGJMFIZITROKBP-HYXAFXHYSA-N
XLogP0.76
TPSA49.81 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.13
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-4-aminopent-3-enenitrile?
The IUPAC name of (Z)-4-aminopent-3-enenitrile (CID 55289579) is (Z)-4-aminopent-3-enenitrile.
What is the SMILES notation for (Z)-4-aminopent-3-enenitrile?
The canonical SMILES for (Z)-4-aminopent-3-enenitrile is C/C(N)=C/CC#N.
What is the InChIKey of (Z)-4-aminopent-3-enenitrile?
The InChIKey is XGJMFIZITROKBP-HYXAFXHYSA-N. The full InChI is InChI=1S/C5H8N2/c1-5(7)3-2-4-6/h3H,2,7H2,1H3/b5-3-.
What are the key properties of (Z)-4-aminopent-3-enenitrile?
(Z)-4-aminopent-3-enenitrile has a molecular weight of 96.13 g/mol, XLogP of 0.76, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-aminopent-3-enenitrile is sourced from PubChem (CID 55289579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).