1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine

C12H18N2O — CID 58531206

IUPAC1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine
SMILESCC(C)c1nnc(C(C)C)c2c1COC2
InChIInChI=1S/C12H18N2O/c1-7(2)11-9-5-15-6-10(9)12(8(3)4)14-13-11/h7-8H,5-6H2,1-4H3
InChIKeyGGOIMHYCSZXAJC-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.75
Rot. Bonds2

About 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine

1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine (PubChem CID 58531206) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine.

Molecular Properties

Compound Name1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine
PubChem CID58531206
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine
SMILESCC(C)c1nnc(C(C)C)c2c1COC2
InChIInChI=1S/C12H18N2O/c1-7(2)11-9-5-15-6-10(9)12(8(3)4)14-13-11/h7-8H,5-6H2,1-4H3
InChIKeyGGOIMHYCSZXAJC-UHFFFAOYSA-N
XLogP2.75
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine?
The IUPAC name of 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine (CID 58531206) is 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine.
What is the SMILES notation for 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine?
The canonical SMILES for 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine is CC(C)c1nnc(C(C)C)c2c1COC2.
What is the InChIKey of 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine?
The InChIKey is GGOIMHYCSZXAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-7(2)11-9-5-15-6-10(9)12(8(3)4)14-13-11/h7-8H,5-6H2,1-4H3.
What are the key properties of 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine?
1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine has a molecular weight of 206.29 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-di(propan-2-yl)-5,7-dihydrofuro[3,4-d]pyridazine is sourced from PubChem (CID 58531206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).