4-fluoro-7-methyl-3-propan-2-yl-2H-indazole

C11H13FN2 — CID 118119319

IUPAC4-fluoro-7-methyl-3-propan-2-yl-2H-indazole
SMILESCc1ccc(F)c2c(C(C)C)[nH]nc12
InChIInChI=1S/C11H13FN2/c1-6(2)10-9-8(12)5-4-7(3)11(9)14-13-10/h4-6H,1-3H3,(H,13,14)
InChIKeyDZNDXOZRTCOCPY-UHFFFAOYSA-N
MW192.24 g/mol
LogP3.13
Rot. Bonds1

About 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole

4-fluoro-7-methyl-3-propan-2-yl-2H-indazole (PubChem CID 118119319) has the molecular formula C11H13FN2 and a molecular weight of 192.24 g/mol. Its IUPAC name is 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole.

Molecular Properties

Compound Name4-fluoro-7-methyl-3-propan-2-yl-2H-indazole
PubChem CID118119319
Molecular FormulaC11H13FN2
Molecular Weight192.24 g/mol
Exact Mass192.11
IUPAC Name4-fluoro-7-methyl-3-propan-2-yl-2H-indazole
SMILESCc1ccc(F)c2c(C(C)C)[nH]nc12
InChIInChI=1S/C11H13FN2/c1-6(2)10-9-8(12)5-4-7(3)11(9)14-13-10/h4-6H,1-3H3,(H,13,14)
InChIKeyDZNDXOZRTCOCPY-UHFFFAOYSA-N
XLogP3.13
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole?
The IUPAC name of 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole (CID 118119319) is 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole.
What is the SMILES notation for 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole?
The canonical SMILES for 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole is Cc1ccc(F)c2c(C(C)C)[nH]nc12.
What is the InChIKey of 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole?
The InChIKey is DZNDXOZRTCOCPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2/c1-6(2)10-9-8(12)5-4-7(3)11(9)14-13-10/h4-6H,1-3H3,(H,13,14).
What are the key properties of 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole?
4-fluoro-7-methyl-3-propan-2-yl-2H-indazole has a molecular weight of 192.24 g/mol, XLogP of 3.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-7-methyl-3-propan-2-yl-2H-indazole is sourced from PubChem (CID 118119319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).