3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine

C9H12N2 — CID 58890735

IUPAC3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine
SMILESCc1nnc2c(c1C)CCC2
InChIInChI=1S/C9H12N2/c1-6-7(2)10-11-9-5-3-4-8(6)9/h3-5H2,1-2H3
InChIKeyYTEIFKJRGDTWPB-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.58
Rot. Bonds

About 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine

3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine (PubChem CID 58890735) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine.

Molecular Properties

Compound Name3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine
PubChem CID58890735
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine
SMILESCc1nnc2c(c1C)CCC2
InChIInChI=1S/C9H12N2/c1-6-7(2)10-11-9-5-3-4-8(6)9/h3-5H2,1-2H3
InChIKeyYTEIFKJRGDTWPB-UHFFFAOYSA-N
XLogP1.58
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine?
The IUPAC name of 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine (CID 58890735) is 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine.
What is the SMILES notation for 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine?
The canonical SMILES for 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine is Cc1nnc2c(c1C)CCC2.
What is the InChIKey of 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine?
The InChIKey is YTEIFKJRGDTWPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c1-6-7(2)10-11-9-5-3-4-8(6)9/h3-5H2,1-2H3.
What are the key properties of 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine?
3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine has a molecular weight of 148.21 g/mol, XLogP of 1.58, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridazine is sourced from PubChem (CID 58890735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).