(9Z)-cycloocta[c]pyridazine

C10H8N2 — CID 174694793

IUPAC(9Z)-cycloocta[c]pyridazine
SMILESC1=C/C=C\c2nnccc2C=C1
InChIInChI=1S/C10H8N2/c1-2-4-6-10-9(5-3-1)7-8-11-12-10/h1-8H/b2-1?,3-1?,4-2?,5-3?,6-4-,9-5?,10-6+
InChIKeyLVXISFZEKNJQEN-XACWYRECSA-N
MW156.19 g/mol
LogP2.07
Rot. Bonds

About (9Z)-cycloocta[c]pyridazine

(9Z)-cycloocta[c]pyridazine (PubChem CID 174694793) has the molecular formula C10H8N2 and a molecular weight of 156.19 g/mol. Its IUPAC name is (9Z)-cycloocta[c]pyridazine.

Molecular Properties

Compound Name(9Z)-cycloocta[c]pyridazine
PubChem CID174694793
Molecular FormulaC10H8N2
Molecular Weight156.19 g/mol
Exact Mass156.07
IUPAC Name(9Z)-cycloocta[c]pyridazine
SMILESC1=C/C=C\c2nnccc2C=C1
InChIInChI=1S/C10H8N2/c1-2-4-6-10-9(5-3-1)7-8-11-12-10/h1-8H/b2-1?,3-1?,4-2?,5-3?,6-4-,9-5?,10-6+
InChIKeyLVXISFZEKNJQEN-XACWYRECSA-N
XLogP2.07
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (9Z)-cycloocta[c]pyridazine?
The IUPAC name of (9Z)-cycloocta[c]pyridazine (CID 174694793) is (9Z)-cycloocta[c]pyridazine.
What is the SMILES notation for (9Z)-cycloocta[c]pyridazine?
The canonical SMILES for (9Z)-cycloocta[c]pyridazine is C1=C/C=C\c2nnccc2C=C1.
What is the InChIKey of (9Z)-cycloocta[c]pyridazine?
The InChIKey is LVXISFZEKNJQEN-XACWYRECSA-N. The full InChI is InChI=1S/C10H8N2/c1-2-4-6-10-9(5-3-1)7-8-11-12-10/h1-8H/b2-1?,3-1?,4-2?,5-3?,6-4-,9-5?,10-6+.
What are the key properties of (9Z)-cycloocta[c]pyridazine?
(9Z)-cycloocta[c]pyridazine has a molecular weight of 156.19 g/mol, XLogP of 2.07, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (9Z)-cycloocta[c]pyridazine is sourced from PubChem (CID 174694793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).