3-tert-butyl-1-methyl-6-methylidenepyridazine

C10H16N2 — CID 58386253

IUPAC3-tert-butyl-1-methyl-6-methylidenepyridazine
SMILESC=C1C=CC(C(C)(C)C)=NN1C
InChIInChI=1S/C10H16N2/c1-8-6-7-9(10(2,3)4)11-12(8)5/h6-7H,1H2,2-5H3
InChIKeyKVOFMJIULNHGTM-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.40
Rot. Bonds

About 3-tert-butyl-1-methyl-6-methylidenepyridazine

3-tert-butyl-1-methyl-6-methylidenepyridazine (PubChem CID 58386253) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 3-tert-butyl-1-methyl-6-methylidenepyridazine.

Molecular Properties

Compound Name3-tert-butyl-1-methyl-6-methylidenepyridazine
PubChem CID58386253
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name3-tert-butyl-1-methyl-6-methylidenepyridazine
SMILESC=C1C=CC(C(C)(C)C)=NN1C
InChIInChI=1S/C10H16N2/c1-8-6-7-9(10(2,3)4)11-12(8)5/h6-7H,1H2,2-5H3
InChIKeyKVOFMJIULNHGTM-UHFFFAOYSA-N
XLogP2.40
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-tert-butyl-1-methyl-6-methylidenepyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Methyl-6-methylidene-3-propan-2-ylpyridazine
CID 58334537
3-Tert-butyl-6-methylidene-1-propan-2-ylpyridazine
CID 59802697
6-ethenyl-3-propan-2-yl-1-[(Z)-prop-1-enyl]-4H-pyridazine
CID 134286518
4-imino-N,N,3-trimethyl-3-[(Z)-prop-1-enyl]cyclohexa-1,5-dien-1-amine
CID 134547727
1-(3-tert-butyl-6-methylidenepyridazin-1-yl)-N-methylmethanimine
CID 135228044
(Z)-but-2-ene;N-methyl-N-[(E)-[(Z,4E)-4-prop-2-enylideneoct-5-en-3-ylidene]amino]buta-1,3-dien-2-amine
CID 142877910
N-methyl-N-[(Z)-3-methylbut-3-en-2-ylideneamino]cyclohexa-1,3-dien-1-amine
CID 143175953
1-Methyl-6-methylidene-3-prop-1-en-2-ylpyridazine
CID 143480957
1,3-Dimethyl-6-methylidenepyridazine;ethane
CID 145026718
3-Ethyl-3,7,7-trimethylpyridazino[1,6-a]azepine
CID 156490738
4-Tert-butyl-1-methyl-6-methylidenepyridazine
CID 167564376
N-(2-methylidene-5-propan-2-yl-1-pyridinyl)propan-2-imine
CID 169851119

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-1-methyl-6-methylidenepyridazine?
The IUPAC name of 3-tert-butyl-1-methyl-6-methylidenepyridazine (CID 58386253) is 3-tert-butyl-1-methyl-6-methylidenepyridazine.
What is the SMILES notation for 3-tert-butyl-1-methyl-6-methylidenepyridazine?
The canonical SMILES for 3-tert-butyl-1-methyl-6-methylidenepyridazine is C=C1C=CC(C(C)(C)C)=NN1C.
What is the InChIKey of 3-tert-butyl-1-methyl-6-methylidenepyridazine?
The InChIKey is KVOFMJIULNHGTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-8-6-7-9(10(2,3)4)11-12(8)5/h6-7H,1H2,2-5H3.
What are the key properties of 3-tert-butyl-1-methyl-6-methylidenepyridazine?
3-tert-butyl-1-methyl-6-methylidenepyridazine has a molecular weight of 164.25 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-1-methyl-6-methylidenepyridazine is sourced from PubChem (CID 58386253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).