4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine

C8H11N3 — CID 174263196

IUPAC4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine
SMILESCc1nnc(C)c2c1CCN2
InChIInChI=1S/C8H11N3/c1-5-7-3-4-9-8(7)6(2)11-10-5/h9H,3-4H2,1-2H3
InChIKeyVUXSLXQDJSUMGW-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.06
Rot. Bonds

About 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine

4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine (PubChem CID 174263196) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine.

Molecular Properties

Compound Name4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine
PubChem CID174263196
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine
SMILESCc1nnc(C)c2c1CCN2
InChIInChI=1S/C8H11N3/c1-5-7-3-4-9-8(7)6(2)11-10-5/h9H,3-4H2,1-2H3
InChIKeyVUXSLXQDJSUMGW-UHFFFAOYSA-N
XLogP1.06
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methyl-4,7-bis(trifluoromethyl)-2,3-dihydropyrrolo[2,3-d]pyridazine
CID 134987024
14-Fluoro-4,8,9-triazatricyclo[7.5.0.02,7]tetradeca-1,7,13-triene
CID 155352887
1,2,6,7-tetramethyl-4,5-dihydro-3H-pyrrolo[3,2-c]pyridazine
CID 58095900
1,6,7-Trimethyl-2,3,4,5-tetrahydro-1H-pyrrolo[3,2-c]pyridazine
CID 66846991
1,3-dimethyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 82586427
2,3-Dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
CID 82651549
1-Ethyl-3-methyl-4,5,6,7-tetrahydropyrazolo[4,5-c]pyridine
CID 84647034
1-Benzyl-3-methyl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
CID 130214347
3,6,7-trimethyl-6,7-dihydro-5H-pyrrolo[3,2-c]pyridazine
CID 130335702
(6E,7E)-3,4-bis(ethenyl)-6-ethylidene-7-prop-2-enylidene-5H-pyrrolo[3,2-c]pyridazine;ethane;propane
CID 144113357
3,4-bis(ethenyl)-8-methyl-7,8-dihydro-5H-pyridazino[4,3-b]indole;ethane
CID 144113476
13-Methanimidoyl-4,8,9-triazatricyclo[7.5.0.02,7]tetradeca-1,7,13-trien-14-amine
CID 155731945

Frequently Asked Questions

What is the IUPAC name of 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine?
The IUPAC name of 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine (CID 174263196) is 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine.
What is the SMILES notation for 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine?
The canonical SMILES for 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine is Cc1nnc(C)c2c1CCN2.
What is the InChIKey of 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine?
The InChIKey is VUXSLXQDJSUMGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-5-7-3-4-9-8(7)6(2)11-10-5/h9H,3-4H2,1-2H3.
What are the key properties of 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine?
4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine has a molecular weight of 149.20 g/mol, XLogP of 1.06, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,7-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-d]pyridazine is sourced from PubChem (CID 174263196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).