5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine

C11H16N2 — CID 58975459

IUPAC5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine
SMILESCC1(C)CC(C)(C)c2cnncc21
InChIInChI=1S/C11H16N2/c1-10(2)7-11(3,4)9-6-13-12-5-8(9)10/h5-6H,7H2,1-4H3
InChIKeyVBLSDPRTFRFCMB-UHFFFAOYSA-N
MW176.26 g/mol
LogP2.44
Rot. Bonds

About 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine

5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine (PubChem CID 58975459) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine.

Molecular Properties

Compound Name5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine
PubChem CID58975459
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine
SMILESCC1(C)CC(C)(C)c2cnncc21
InChIInChI=1S/C11H16N2/c1-10(2)7-11(3,4)9-6-13-12-5-8(9)10/h5-6H,7H2,1-4H3
InChIKeyVBLSDPRTFRFCMB-UHFFFAOYSA-N
XLogP2.44
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine?
The IUPAC name of 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine (CID 58975459) is 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine.
What is the SMILES notation for 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine?
The canonical SMILES for 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine is CC1(C)CC(C)(C)c2cnncc21.
What is the InChIKey of 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine?
The InChIKey is VBLSDPRTFRFCMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-10(2)7-11(3,4)9-6-13-12-5-8(9)10/h5-6H,7H2,1-4H3.
What are the key properties of 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine?
5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine has a molecular weight of 176.26 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,7,7-tetramethyl-6H-cyclopenta[d]pyridazine is sourced from PubChem (CID 58975459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).