3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine

C8H13N3 — CID 82417292

IUPAC3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine
SMILESCc1[nH]nc2c1CCC(N)C2
InChIInChI=1S/C8H13N3/c1-5-7-3-2-6(9)4-8(7)11-10-5/h6H,2-4,9H2,1H3,(H,10,11)
InChIKeyOOOAYVNFVFIESQ-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.53
Rot. Bonds

About 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine

3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine (PubChem CID 82417292) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine.

Molecular Properties

Compound Name3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine
PubChem CID82417292
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine
SMILESCc1[nH]nc2c1CCC(N)C2
InChIInChI=1S/C8H13N3/c1-5-7-3-2-6(9)4-8(7)11-10-5/h6H,2-4,9H2,1H3,(H,10,11)
InChIKeyOOOAYVNFVFIESQ-UHFFFAOYSA-N
XLogP0.53
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine?
The IUPAC name of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine (CID 82417292) is 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine.
What is the SMILES notation for 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine?
The canonical SMILES for 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine is Cc1[nH]nc2c1CCC(N)C2.
What is the InChIKey of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine?
The InChIKey is OOOAYVNFVFIESQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-5-7-3-2-6(9)4-8(7)11-10-5/h6H,2-4,9H2,1H3,(H,10,11).
What are the key properties of 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine?
3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine has a molecular weight of 151.21 g/mol, XLogP of 0.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4,5,6,7-tetrahydro-2H-indazol-6-amine is sourced from PubChem (CID 82417292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).