4,5-dimethyl-1,2,3,4-tetrahydropyridazine

C6H12N2 — CID 135162433

IUPAC4,5-dimethyl-1,2,3,4-tetrahydropyridazine
SMILESCC1=CNNCC1C
InChIInChI=1S/C6H12N2/c1-5-3-7-8-4-6(5)2/h3,6-8H,4H2,1-2H3
InChIKeyJNTYFGHPDQWSFM-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.63
Rot. Bonds

About 4,5-dimethyl-1,2,3,4-tetrahydropyridazine

4,5-dimethyl-1,2,3,4-tetrahydropyridazine (PubChem CID 135162433) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 4,5-dimethyl-1,2,3,4-tetrahydropyridazine.

Molecular Properties

Compound Name4,5-dimethyl-1,2,3,4-tetrahydropyridazine
PubChem CID135162433
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name4,5-dimethyl-1,2,3,4-tetrahydropyridazine
SMILESCC1=CNNCC1C
InChIInChI=1S/C6H12N2/c1-5-3-7-8-4-6(5)2/h3,6-8H,4H2,1-2H3
InChIKeyJNTYFGHPDQWSFM-UHFFFAOYSA-N
XLogP0.63
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyl-1,2,3,4-tetrahydropyridazine?
The IUPAC name of 4,5-dimethyl-1,2,3,4-tetrahydropyridazine (CID 135162433) is 4,5-dimethyl-1,2,3,4-tetrahydropyridazine.
What is the SMILES notation for 4,5-dimethyl-1,2,3,4-tetrahydropyridazine?
The canonical SMILES for 4,5-dimethyl-1,2,3,4-tetrahydropyridazine is CC1=CNNCC1C.
What is the InChIKey of 4,5-dimethyl-1,2,3,4-tetrahydropyridazine?
The InChIKey is JNTYFGHPDQWSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-5-3-7-8-4-6(5)2/h3,6-8H,4H2,1-2H3.
What are the key properties of 4,5-dimethyl-1,2,3,4-tetrahydropyridazine?
4,5-dimethyl-1,2,3,4-tetrahydropyridazine has a molecular weight of 112.18 g/mol, XLogP of 0.63, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyl-1,2,3,4-tetrahydropyridazine is sourced from PubChem (CID 135162433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).