7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine

C17H10F6N4 — CID 134457863

IUPAC7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCc1cc(-c2c(C(F)(F)F)ccc3cc(C(F)(F)F)nn23)cc2cn[nH]c12
InChIInChI=1S/C17H10F6N4/c1-8-4-9(5-10-7-24-25-14(8)10)15-12(16(18,19)20)3-2-11-6-13(17(21,22)23)26-27(11)15/h2-7H,1H3,(H,24,25)
InChIKeyVZWMJFRJNXMQDQ-UHFFFAOYSA-N
MW384.28 g/mol
LogP5.22
Rot. Bonds1

About 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine

7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 134457863) has the molecular formula C17H10F6N4 and a molecular weight of 384.28 g/mol. Its IUPAC name is 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID134457863
Molecular FormulaC17H10F6N4
Molecular Weight384.28 g/mol
Exact Mass384.08
IUPAC Name7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCc1cc(-c2c(C(F)(F)F)ccc3cc(C(F)(F)F)nn23)cc2cn[nH]c12
InChIInChI=1S/C17H10F6N4/c1-8-4-9(5-10-7-24-25-14(8)10)15-12(16(18,19)20)3-2-11-6-13(17(21,22)23)26-27(11)15/h2-7H,1H3,(H,24,25)
InChIKeyVZWMJFRJNXMQDQ-UHFFFAOYSA-N
XLogP5.22
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.28
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 134457863) is 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine is Cc1cc(-c2c(C(F)(F)F)ccc3cc(C(F)(F)F)nn23)cc2cn[nH]c12.
What is the InChIKey of 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is VZWMJFRJNXMQDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F6N4/c1-8-4-9(5-10-7-24-25-14(8)10)15-12(16(18,19)20)3-2-11-6-13(17(21,22)23)26-27(11)15/h2-7H,1H3,(H,24,25).
What are the key properties of 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine?
7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 384.28 g/mol, XLogP of 5.22, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(7-methyl-1H-indazol-5-yl)-2,6-bis(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 134457863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).