5-methylidene-1,2,4,6-tetrahydroindazole

C8H10N2 — CID 123991323

IUPAC5-methylidene-1,2,4,6-tetrahydroindazole
SMILESC=C1CC=C2NNC=C2C1
InChIInChI=1S/C8H10N2/c1-6-2-3-8-7(4-6)5-9-10-8/h3,5,9-10H,1-2,4H2
InChIKeyBDXGZYLACBAYOH-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.21
Rot. Bonds

About 5-methylidene-1,2,4,6-tetrahydroindazole

5-methylidene-1,2,4,6-tetrahydroindazole (PubChem CID 123991323) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 5-methylidene-1,2,4,6-tetrahydroindazole.

Molecular Properties

Compound Name5-methylidene-1,2,4,6-tetrahydroindazole
PubChem CID123991323
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name5-methylidene-1,2,4,6-tetrahydroindazole
SMILESC=C1CC=C2NNC=C2C1
InChIInChI=1S/C8H10N2/c1-6-2-3-8-7(4-6)5-9-10-8/h3,5,9-10H,1-2,4H2
InChIKeyBDXGZYLACBAYOH-UHFFFAOYSA-N
XLogP1.21
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.21
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

7-Tetrahydroindazole
CID 123449298
1,2,3,4,5,6-Hexahydrocinnoline
CID 19978302
2,3-Dihydrocyclopenta[e]indazole
CID 59145891
2,4-dihydro-1H-indazole
CID 90911947
3-Propyl-1,2-dihydropyrazolo[1,5-a]pyridine
CID 135158445
(Z)-3-[(1E,4Z)-cycloocta-1,4-dien-1-yl]-3-hydrazinylprop-2-en-1-amine
CID 138631013
(Z)-2-(5,6-dihydro-1H-inden-2-yl)-2-hydrazinylethenamine
CID 138631145
2,3,4,6-tetrahydro-1H-benzo[f]indazole
CID 140046347
2,3,4,5,6,9-hexahydro-1H-benzo[f]indazole
CID 140129882
1,2,3,4,5,8-Hexahydrocyclopenta[f]indazole
CID 141201786
1,3,4,5-Tetrahydroindazol-2-amine
CID 141394248
2,3,4,6-tetrahydro-1H-pyrazolo[3,4-g]isoquinoline
CID 141394682

Frequently Asked Questions

What is the IUPAC name of 5-methylidene-1,2,4,6-tetrahydroindazole?
The IUPAC name of 5-methylidene-1,2,4,6-tetrahydroindazole (CID 123991323) is 5-methylidene-1,2,4,6-tetrahydroindazole.
What is the SMILES notation for 5-methylidene-1,2,4,6-tetrahydroindazole?
The canonical SMILES for 5-methylidene-1,2,4,6-tetrahydroindazole is C=C1CC=C2NNC=C2C1.
What is the InChIKey of 5-methylidene-1,2,4,6-tetrahydroindazole?
The InChIKey is BDXGZYLACBAYOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-6-2-3-8-7(4-6)5-9-10-8/h3,5,9-10H,1-2,4H2.
What are the key properties of 5-methylidene-1,2,4,6-tetrahydroindazole?
5-methylidene-1,2,4,6-tetrahydroindazole has a molecular weight of 134.18 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-1,2,4,6-tetrahydroindazole is sourced from PubChem (CID 123991323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).