1-methyl-5,6-dihydroindazole

C8H10N2 — CID 137468550

IUPAC1-methyl-5,6-dihydroindazole
SMILESCn1ncc2c1=CCCC=2
InChIInChI=1S/C8H10N2/c1-10-8-5-3-2-4-7(8)6-9-10/h4-6H,2-3H2,1H3
InChIKeyUMYYZEXAGYMPGX-UHFFFAOYSA-N
MW134.18 g/mol
LogP-0.23
Rot. Bonds

About 1-methyl-5,6-dihydroindazole

1-methyl-5,6-dihydroindazole (PubChem CID 137468550) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 1-methyl-5,6-dihydroindazole.

Molecular Properties

Compound Name1-methyl-5,6-dihydroindazole
PubChem CID137468550
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name1-methyl-5,6-dihydroindazole
SMILESCn1ncc2c1=CCCC=2
InChIInChI=1S/C8H10N2/c1-10-8-5-3-2-4-7(8)6-9-10/h4-6H,2-3H2,1H3
InChIKeyUMYYZEXAGYMPGX-UHFFFAOYSA-N
XLogP-0.23
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5,6-dihydroindazole?
The IUPAC name of 1-methyl-5,6-dihydroindazole (CID 137468550) is 1-methyl-5,6-dihydroindazole.
What is the SMILES notation for 1-methyl-5,6-dihydroindazole?
The canonical SMILES for 1-methyl-5,6-dihydroindazole is Cn1ncc2c1=CCCC=2.
What is the InChIKey of 1-methyl-5,6-dihydroindazole?
The InChIKey is UMYYZEXAGYMPGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-10-8-5-3-2-4-7(8)6-9-10/h4-6H,2-3H2,1H3.
What are the key properties of 1-methyl-5,6-dihydroindazole?
1-methyl-5,6-dihydroindazole has a molecular weight of 134.18 g/mol, XLogP of -0.23, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5,6-dihydroindazole is sourced from PubChem (CID 137468550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).