1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine

C13H18N2 — CID 123464597

IUPAC1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine
SMILESC=CC=CC=C(C)N(N)C1C=CC=CC1
InChIInChI=1S/C13H18N2/c1-3-4-6-9-12(2)15(14)13-10-7-5-8-11-13/h3-10,13H,1,11,14H2,2H3
InChIKeyVLZMTUPUBBHQRY-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.69
Rot. Bonds4

About 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine

1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine (PubChem CID 123464597) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine.

Molecular Properties

Compound Name1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine
PubChem CID123464597
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine
SMILESC=CC=CC=C(C)N(N)C1C=CC=CC1
InChIInChI=1S/C13H18N2/c1-3-4-6-9-12(2)15(14)13-10-7-5-8-11-13/h3-10,13H,1,11,14H2,2H3
InChIKeyVLZMTUPUBBHQRY-UHFFFAOYSA-N
XLogP2.69
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine?
The IUPAC name of 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine (CID 123464597) is 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine.
What is the SMILES notation for 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine?
The canonical SMILES for 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine is C=CC=CC=C(C)N(N)C1C=CC=CC1.
What is the InChIKey of 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine?
The InChIKey is VLZMTUPUBBHQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-3-4-6-9-12(2)15(14)13-10-7-5-8-11-13/h3-10,13H,1,11,14H2,2H3.
What are the key properties of 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine?
1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine has a molecular weight of 202.30 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexa-2,4-dien-1-yl-1-hepta-2,4,6-trien-2-ylhydrazine is sourced from PubChem (CID 123464597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).