3,5-dimethyl-4-methylidenepyrazolidine

C6H12N2 — CID 123346046

IUPAC3,5-dimethyl-4-methylidenepyrazolidine
SMILESC=C1C(C)NNC1C
InChIInChI=1S/C6H12N2/c1-4-5(2)7-8-6(4)3/h5-8H,1H2,2-3H3
InChIKeyCXQACYIQXYTQLB-UHFFFAOYSA-N
MW112.18 g/mol
LogP0.43
Rot. Bonds

About 3,5-dimethyl-4-methylidenepyrazolidine

3,5-dimethyl-4-methylidenepyrazolidine (PubChem CID 123346046) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 3,5-dimethyl-4-methylidenepyrazolidine.

Molecular Properties

Compound Name3,5-dimethyl-4-methylidenepyrazolidine
PubChem CID123346046
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name3,5-dimethyl-4-methylidenepyrazolidine
SMILESC=C1C(C)NNC1C
InChIInChI=1S/C6H12N2/c1-4-5(2)7-8-6(4)3/h5-8H,1H2,2-3H3
InChIKeyCXQACYIQXYTQLB-UHFFFAOYSA-N
XLogP0.43
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 ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-Methylbut-3-en-2-ylhydrazine
CID 55280952
3-Methyl-4-methylidenepyrazolidine
CID 58995820
2-Methylpent-1-en-3-ylhydrazine
CID 89317901
(3R)-4-ethyl-3-methyl-2,3-dihydro-1H-pyrazole
CID 90071112
4-ethyl-3-methyl-2,3-dihydro-1H-pyrazole
CID 118478900
1-Methyl-5-prop-1-en-2-ylpyrazolidine
CID 123678186
1-Methyl-2-(3-methylbut-3-en-2-yl)hydrazine
CID 129302731
2-Methyl-3-[2-(methylamino)hydrazinyl]but-1-ene
CID 163666927
[(2S)-3-methylbut-3-en-2-yl]hydrazine
CID 164011685
2-Hydrazinyl-3-methylbut-3-en-1-amine
CID 164101359
4-Methylpent-4-en-2-ylhydrazine
CID 105201348
[(2R)-3-methylbut-3-en-2-yl]hydrazine
CID 130806085

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-methylidenepyrazolidine?
The IUPAC name of 3,5-dimethyl-4-methylidenepyrazolidine (CID 123346046) is 3,5-dimethyl-4-methylidenepyrazolidine.
What is the SMILES notation for 3,5-dimethyl-4-methylidenepyrazolidine?
The canonical SMILES for 3,5-dimethyl-4-methylidenepyrazolidine is C=C1C(C)NNC1C.
What is the InChIKey of 3,5-dimethyl-4-methylidenepyrazolidine?
The InChIKey is CXQACYIQXYTQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2/c1-4-5(2)7-8-6(4)3/h5-8H,1H2,2-3H3.
What are the key properties of 3,5-dimethyl-4-methylidenepyrazolidine?
3,5-dimethyl-4-methylidenepyrazolidine has a molecular weight of 112.18 g/mol, XLogP of 0.43, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-methylidenepyrazolidine is sourced from PubChem (CID 123346046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).