6-methyl-5-propan-2-yl-1H-indazole

C11H14N2 — CID 58371515

IUPAC6-methyl-5-propan-2-yl-1H-indazole
SMILESCc1cc2[nH]ncc2cc1C(C)C
InChIInChI=1S/C11H14N2/c1-7(2)10-5-9-6-12-13-11(9)4-8(10)3/h4-7H,1-3H3,(H,12,13)
InChIKeyFFNFKGIVIWYAGJ-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.99
Rot. Bonds1

About 6-methyl-5-propan-2-yl-1H-indazole

6-methyl-5-propan-2-yl-1H-indazole (PubChem CID 58371515) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 6-methyl-5-propan-2-yl-1H-indazole.

Molecular Properties

Compound Name6-methyl-5-propan-2-yl-1H-indazole
PubChem CID58371515
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name6-methyl-5-propan-2-yl-1H-indazole
SMILESCc1cc2[nH]ncc2cc1C(C)C
InChIInChI=1S/C11H14N2/c1-7(2)10-5-9-6-12-13-11(9)4-8(10)3/h4-7H,1-3H3,(H,12,13)
InChIKeyFFNFKGIVIWYAGJ-UHFFFAOYSA-N
XLogP2.99
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-propan-2-yl-1H-indazole?
The IUPAC name of 6-methyl-5-propan-2-yl-1H-indazole (CID 58371515) is 6-methyl-5-propan-2-yl-1H-indazole.
What is the SMILES notation for 6-methyl-5-propan-2-yl-1H-indazole?
The canonical SMILES for 6-methyl-5-propan-2-yl-1H-indazole is Cc1cc2[nH]ncc2cc1C(C)C.
What is the InChIKey of 6-methyl-5-propan-2-yl-1H-indazole?
The InChIKey is FFNFKGIVIWYAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-7(2)10-5-9-6-12-13-11(9)4-8(10)3/h4-7H,1-3H3,(H,12,13).
What are the key properties of 6-methyl-5-propan-2-yl-1H-indazole?
6-methyl-5-propan-2-yl-1H-indazole has a molecular weight of 174.25 g/mol, XLogP of 2.99, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-propan-2-yl-1H-indazole is sourced from PubChem (CID 58371515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).