1,5-dimethyl-6-(trifluoromethyl)indazole

C10H9F3N2 — CID 147922092

IUPAC1,5-dimethyl-6-(trifluoromethyl)indazole
SMILESCc1cc2cnn(C)c2cc1C(F)(F)F
InChIInChI=1S/C10H9F3N2/c1-6-3-7-5-14-15(2)9(7)4-8(6)10(11,12)13/h3-5H,1-2H3
InChIKeyIIFSBNRKGXFZFY-UHFFFAOYSA-N
MW214.19 g/mol
LogP2.90
Rot. Bonds

About 1,5-dimethyl-6-(trifluoromethyl)indazole

1,5-dimethyl-6-(trifluoromethyl)indazole (PubChem CID 147922092) has the molecular formula C10H9F3N2 and a molecular weight of 214.19 g/mol. Its IUPAC name is 1,5-dimethyl-6-(trifluoromethyl)indazole.

Molecular Properties

Compound Name1,5-dimethyl-6-(trifluoromethyl)indazole
PubChem CID147922092
Molecular FormulaC10H9F3N2
Molecular Weight214.19 g/mol
Exact Mass214.07
IUPAC Name1,5-dimethyl-6-(trifluoromethyl)indazole
SMILESCc1cc2cnn(C)c2cc1C(F)(F)F
InChIInChI=1S/C10H9F3N2/c1-6-3-7-5-14-15(2)9(7)4-8(6)10(11,12)13/h3-5H,1-2H3
InChIKeyIIFSBNRKGXFZFY-UHFFFAOYSA-N
XLogP2.90
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-6-(trifluoromethyl)indazole?
The IUPAC name of 1,5-dimethyl-6-(trifluoromethyl)indazole (CID 147922092) is 1,5-dimethyl-6-(trifluoromethyl)indazole.
What is the SMILES notation for 1,5-dimethyl-6-(trifluoromethyl)indazole?
The canonical SMILES for 1,5-dimethyl-6-(trifluoromethyl)indazole is Cc1cc2cnn(C)c2cc1C(F)(F)F.
What is the InChIKey of 1,5-dimethyl-6-(trifluoromethyl)indazole?
The InChIKey is IIFSBNRKGXFZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2/c1-6-3-7-5-14-15(2)9(7)4-8(6)10(11,12)13/h3-5H,1-2H3.
What are the key properties of 1,5-dimethyl-6-(trifluoromethyl)indazole?
1,5-dimethyl-6-(trifluoromethyl)indazole has a molecular weight of 214.19 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-6-(trifluoromethyl)indazole is sourced from PubChem (CID 147922092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).