6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine

C8H11N3 — CID 144718923

IUPAC6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine
SMILES[H]/N=c1\ccc(C)nn1/C=C\C
InChIInChI=1S/C8H11N3/c1-3-6-11-8(9)5-4-7(2)10-11/h3-6,9H,1-2H3/b6-3-,9-8+
InChIKeyGEDDXBJDDWGNIN-IAAUUEAGSA-N
MW149.20 g/mol
LogP1.16
Rot. Bonds1

About 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine

6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine (PubChem CID 144718923) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine.

Molecular Properties

Compound Name6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine
PubChem CID144718923
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine
SMILES[H]/N=c1\ccc(C)nn1/C=C\C
InChIInChI=1S/C8H11N3/c1-3-6-11-8(9)5-4-7(2)10-11/h3-6,9H,1-2H3/b6-3-,9-8+
InChIKeyGEDDXBJDDWGNIN-IAAUUEAGSA-N
XLogP1.16
TPSA41.67 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine?
The IUPAC name of 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine (CID 144718923) is 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine.
What is the SMILES notation for 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine?
The canonical SMILES for 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine is [H]/N=c1\ccc(C)nn1/C=C\C.
What is the InChIKey of 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine?
The InChIKey is GEDDXBJDDWGNIN-IAAUUEAGSA-N. The full InChI is InChI=1S/C8H11N3/c1-3-6-11-8(9)5-4-7(2)10-11/h3-6,9H,1-2H3/b6-3-,9-8+.
What are the key properties of 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine?
6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine has a molecular weight of 149.20 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[(Z)-prop-1-enyl]pyridazin-3-imine is sourced from PubChem (CID 144718923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).