ethyl-[(Z)-pent-3-en-2-yl]diazene

C7H14N2 — CID 163748683

IUPACethyl-[(Z)-pent-3-en-2-yl]diazene
SMILESC/C=C\C(C)/N=N/CC
InChIInChI=1S/C7H14N2/c1-4-6-7(3)9-8-5-2/h4,6-7H,5H2,1-3H3/b6-4-,9-8+
InChIKeyLOCSZRYDNWYWOQ-LJWGDIBWSA-N
MW126.20 g/mol
LogP2.42
Rot. Bonds3

About ethyl-[(Z)-pent-3-en-2-yl]diazene

ethyl-[(Z)-pent-3-en-2-yl]diazene (PubChem CID 163748683) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is ethyl-[(Z)-pent-3-en-2-yl]diazene.

Molecular Properties

Compound Nameethyl-[(Z)-pent-3-en-2-yl]diazene
PubChem CID163748683
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Nameethyl-[(Z)-pent-3-en-2-yl]diazene
SMILESC/C=C\C(C)/N=N/CC
InChIInChI=1S/C7H14N2/c1-4-6-7(3)9-8-5-2/h4,6-7H,5H2,1-3H3/b6-4-,9-8+
InChIKeyLOCSZRYDNWYWOQ-LJWGDIBWSA-N
XLogP2.42
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.42
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl-[(Z)-pent-3-en-2-yl]diazene?
The IUPAC name of ethyl-[(Z)-pent-3-en-2-yl]diazene (CID 163748683) is ethyl-[(Z)-pent-3-en-2-yl]diazene.
What is the SMILES notation for ethyl-[(Z)-pent-3-en-2-yl]diazene?
The canonical SMILES for ethyl-[(Z)-pent-3-en-2-yl]diazene is C/C=C\C(C)/N=N/CC.
What is the InChIKey of ethyl-[(Z)-pent-3-en-2-yl]diazene?
The InChIKey is LOCSZRYDNWYWOQ-LJWGDIBWSA-N. The full InChI is InChI=1S/C7H14N2/c1-4-6-7(3)9-8-5-2/h4,6-7H,5H2,1-3H3/b6-4-,9-8+.
What are the key properties of ethyl-[(Z)-pent-3-en-2-yl]diazene?
ethyl-[(Z)-pent-3-en-2-yl]diazene has a molecular weight of 126.20 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-[(Z)-pent-3-en-2-yl]diazene is sourced from PubChem (CID 163748683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).