4-propoxypyridazine

C7H10N2O — CID 91109655

IUPAC4-propoxypyridazine
SMILESCCCOc1ccnnc1
InChIInChI=1S/C7H10N2O/c1-2-5-10-7-3-4-8-9-6-7/h3-4,6H,2,5H2,1H3
InChIKeyCUFSGSROVDCLML-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.27
Rot. Bonds3

About 4-propoxypyridazine

4-propoxypyridazine (PubChem CID 91109655) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 4-propoxypyridazine.

Molecular Properties

Compound Name4-propoxypyridazine
PubChem CID91109655
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name4-propoxypyridazine
SMILESCCCOc1ccnnc1
InChIInChI=1S/C7H10N2O/c1-2-5-10-7-3-4-8-9-6-7/h3-4,6H,2,5H2,1H3
InChIKeyCUFSGSROVDCLML-UHFFFAOYSA-N
XLogP1.27
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methoxypyridazine
CID 14792125
3-Chloro-5-methoxypyridazine
CID 10975612
3,5-Dimethoxypyridazine
CID 254101
4-Methoxypyridazin-3-amine
CID 11147715
3-Bromo-5-methoxypyridazine
CID 118497529
3-Bromo-4-methoxypyridazine
CID 154674574
4-Methoxy-5-methylpyridazin
CID 13205681
3-Chloro-5-(2,2,2-trifluoroethoxy)pyridazine
CID 71303437
4-(2,2-Difluoropropoxy)pyridazine
CID 142795297
4-(2,2,2-Trifluoroethoxy)pyridazine
CID 151422416
3-fluoro-4-pyridazin-4-yloxy-3H-pyridazin-4-ol
CID 156087802
4-(Trifluoromethoxy)pyridazine
CID 173598733

Frequently Asked Questions

What is the IUPAC name of 4-propoxypyridazine?
The IUPAC name of 4-propoxypyridazine (CID 91109655) is 4-propoxypyridazine.
What is the SMILES notation for 4-propoxypyridazine?
The canonical SMILES for 4-propoxypyridazine is CCCOc1ccnnc1.
What is the InChIKey of 4-propoxypyridazine?
The InChIKey is CUFSGSROVDCLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-2-5-10-7-3-4-8-9-6-7/h3-4,6H,2,5H2,1H3.
What are the key properties of 4-propoxypyridazine?
4-propoxypyridazine has a molecular weight of 138.17 g/mol, XLogP of 1.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propoxypyridazine is sourced from PubChem (CID 91109655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).