4-(1-methyltetrazol-5-yl)pyridazine

C6H6N6 — CID 139534009

IUPAC4-(1-methyltetrazol-5-yl)pyridazine
SMILESCn1nnnc1-c1ccnnc1
InChIInChI=1S/C6H6N6/c1-12-6(9-10-11-12)5-2-3-7-8-4-5/h2-4H,1H3
InChIKeyFAOFTCSDAIWHNC-UHFFFAOYSA-N
MW162.16 g/mol
LogP-0.33
Rot. Bonds1

About 4-(1-methyltetrazol-5-yl)pyridazine

4-(1-methyltetrazol-5-yl)pyridazine (PubChem CID 139534009) has the molecular formula C6H6N6 and a molecular weight of 162.16 g/mol. Its IUPAC name is 4-(1-methyltetrazol-5-yl)pyridazine.

Molecular Properties

Compound Name4-(1-methyltetrazol-5-yl)pyridazine
PubChem CID139534009
Molecular FormulaC6H6N6
Molecular Weight162.16 g/mol
Exact Mass162.07
IUPAC Name4-(1-methyltetrazol-5-yl)pyridazine
SMILESCn1nnnc1-c1ccnnc1
InChIInChI=1S/C6H6N6/c1-12-6(9-10-11-12)5-2-3-7-8-4-5/h2-4H,1H3
InChIKeyFAOFTCSDAIWHNC-UHFFFAOYSA-N
XLogP-0.33
TPSA69.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.16
LogP ≤ 5-0.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(1-methyltetrazol-5-yl)pyridazine?
The IUPAC name of 4-(1-methyltetrazol-5-yl)pyridazine (CID 139534009) is 4-(1-methyltetrazol-5-yl)pyridazine.
What is the SMILES notation for 4-(1-methyltetrazol-5-yl)pyridazine?
The canonical SMILES for 4-(1-methyltetrazol-5-yl)pyridazine is Cn1nnnc1-c1ccnnc1.
What is the InChIKey of 4-(1-methyltetrazol-5-yl)pyridazine?
The InChIKey is FAOFTCSDAIWHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N6/c1-12-6(9-10-11-12)5-2-3-7-8-4-5/h2-4H,1H3.
What are the key properties of 4-(1-methyltetrazol-5-yl)pyridazine?
4-(1-methyltetrazol-5-yl)pyridazine has a molecular weight of 162.16 g/mol, XLogP of -0.33, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methyltetrazol-5-yl)pyridazine is sourced from PubChem (CID 139534009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).