[(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene

C9H16N2 — CID 146883866

IUPAC[(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene
SMILESC=C(C)/N=N/C(C)=C/CCC
InChIInChI=1S/C9H16N2/c1-5-6-7-9(4)11-10-8(2)3/h7H,2,5-6H2,1,3-4H3/b9-7+,11-10+
InChIKeySURJQLDVIMMSGV-RJECPTDASA-N
MW152.24 g/mol
LogP3.68
Rot. Bonds4

About [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene

[(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene (PubChem CID 146883866) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene.

Molecular Properties

Compound Name[(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene
PubChem CID146883866
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name[(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene
SMILESC=C(C)/N=N/C(C)=C/CCC
InChIInChI=1S/C9H16N2/c1-5-6-7-9(4)11-10-8(2)3/h7H,2,5-6H2,1,3-4H3/b9-7+,11-10+
InChIKeySURJQLDVIMMSGV-RJECPTDASA-N
XLogP3.68
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene?
The IUPAC name of [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene (CID 146883866) is [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene.
What is the SMILES notation for [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene?
The canonical SMILES for [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene is C=C(C)/N=N/C(C)=C/CCC.
What is the InChIKey of [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene?
The InChIKey is SURJQLDVIMMSGV-RJECPTDASA-N. The full InChI is InChI=1S/C9H16N2/c1-5-6-7-9(4)11-10-8(2)3/h7H,2,5-6H2,1,3-4H3/b9-7+,11-10+.
What are the key properties of [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene?
[(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene has a molecular weight of 152.24 g/mol, XLogP of 3.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-hex-2-en-2-yl]-prop-1-en-2-yldiazene is sourced from PubChem (CID 146883866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).