4-methyl-8-methylidenecyclohepta[c]pyridazine

C11H10N2 — CID 143124701

IUPAC4-methyl-8-methylidenecyclohepta[c]pyridazine
SMILESC=C1C=CC=c2c(C)cnnc2=C1
InChIInChI=1S/C11H10N2/c1-8-4-3-5-10-9(2)7-12-13-11(10)6-8/h3-7H,1H2,2H3
InChIKeyGHILMNYOKHEEJO-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.47
Rot. Bonds

About 4-methyl-8-methylidenecyclohepta[c]pyridazine

4-methyl-8-methylidenecyclohepta[c]pyridazine (PubChem CID 143124701) has the molecular formula C11H10N2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 4-methyl-8-methylidenecyclohepta[c]pyridazine.

Molecular Properties

Compound Name4-methyl-8-methylidenecyclohepta[c]pyridazine
PubChem CID143124701
Molecular FormulaC11H10N2
Molecular Weight170.21 g/mol
Exact Mass170.08
IUPAC Name4-methyl-8-methylidenecyclohepta[c]pyridazine
SMILESC=C1C=CC=c2c(C)cnnc2=C1
InChIInChI=1S/C11H10N2/c1-8-4-3-5-10-9(2)7-12-13-11(10)6-8/h3-7H,1H2,2H3
InChIKeyGHILMNYOKHEEJO-UHFFFAOYSA-N
XLogP0.47
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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CID 69059164
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CID 71358921
CID 71358921

Frequently Asked Questions

What is the IUPAC name of 4-methyl-8-methylidenecyclohepta[c]pyridazine?
The IUPAC name of 4-methyl-8-methylidenecyclohepta[c]pyridazine (CID 143124701) is 4-methyl-8-methylidenecyclohepta[c]pyridazine.
What is the SMILES notation for 4-methyl-8-methylidenecyclohepta[c]pyridazine?
The canonical SMILES for 4-methyl-8-methylidenecyclohepta[c]pyridazine is C=C1C=CC=c2c(C)cnnc2=C1.
What is the InChIKey of 4-methyl-8-methylidenecyclohepta[c]pyridazine?
The InChIKey is GHILMNYOKHEEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2/c1-8-4-3-5-10-9(2)7-12-13-11(10)6-8/h3-7H,1H2,2H3.
What are the key properties of 4-methyl-8-methylidenecyclohepta[c]pyridazine?
4-methyl-8-methylidenecyclohepta[c]pyridazine has a molecular weight of 170.21 g/mol, XLogP of 0.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-8-methylidenecyclohepta[c]pyridazine is sourced from PubChem (CID 143124701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).