1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine

C9H14N2O — CID 143987552

IUPAC1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine
SMILESCC1=C2COCC2=C(C)N(C)N1
InChIInChI=1S/C9H14N2O/c1-6-8-4-12-5-9(8)7(2)11(3)10-6/h10H,4-5H2,1-3H3
InChIKeyWVOJSYPBILCSSJ-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.01
Rot. Bonds

About 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine

1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine (PubChem CID 143987552) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine.

Molecular Properties

Compound Name1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine
PubChem CID143987552
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine
SMILESCC1=C2COCC2=C(C)N(C)N1
InChIInChI=1S/C9H14N2O/c1-6-8-4-12-5-9(8)7(2)11(3)10-6/h10H,4-5H2,1-3H3
InChIKeyWVOJSYPBILCSSJ-UHFFFAOYSA-N
XLogP1.01
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine?
The IUPAC name of 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine (CID 143987552) is 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine.
What is the SMILES notation for 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine?
The canonical SMILES for 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine is CC1=C2COCC2=C(C)N(C)N1.
What is the InChIKey of 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine?
The InChIKey is WVOJSYPBILCSSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-6-8-4-12-5-9(8)7(2)11(3)10-6/h10H,4-5H2,1-3H3.
What are the key properties of 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine?
1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine has a molecular weight of 166.22 g/mol, XLogP of 1.01, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,4-trimethyl-5,7-dihydro-2H-furo[3,4-d]pyridazine is sourced from PubChem (CID 143987552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).