2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C12H12F3N5 — CID 168979522

IUPAC2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCc1nn2ccc(C(F)(F)F)cc2c1C1=CN(C)NN1
InChIInChI=1S/C12H12F3N5/c1-7-11(9-6-19(2)18-16-9)10-5-8(12(13,14)15)3-4-20(10)17-7/h3-6,16,18H,1-2H3
InChIKeyFCTLRSXTSFISKG-UHFFFAOYSA-N
MW283.26 g/mol
LogP1.91
Rot. Bonds1

About 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine

2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 168979522) has the molecular formula C12H12F3N5 and a molecular weight of 283.26 g/mol. Its IUPAC name is 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID168979522
Molecular FormulaC12H12F3N5
Molecular Weight283.26 g/mol
Exact Mass283.10
IUPAC Name2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCc1nn2ccc(C(F)(F)F)cc2c1C1=CN(C)NN1
InChIInChI=1S/C12H12F3N5/c1-7-11(9-6-19(2)18-16-9)10-5-8(12(13,14)15)3-4-20(10)17-7/h3-6,16,18H,1-2H3
InChIKeyFCTLRSXTSFISKG-UHFFFAOYSA-N
XLogP1.91
TPSA44.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.26
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethylpyrazolo[1,5-a]pyridine-3-carbaldehyde;5-methylpyrazolo[1,5-a]pyridine-3-carbaldehyde;5-(trifluoromethyl)pyrazolo[1,5-a]pyridine-3-carbaldehyde
CID 87551362
[5-(trifluoromethyl)pyrazolo[1,5-a]pyridin-3-yl]methanol
CID 59476264
3-ethylsulfanyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine-2-carboxylic acid;hydrochloride
CID 137404635
2,5-dimethyl-N-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 122188587
4-[3,5-bis(trifluoromethyl)phenyl]-1,3,5-trimethylpyrazole
CID 102168707
2-methyl-3-[6-(trifluoromethyl)-1H-indazol-4-yl]-6H-pyrazolo[1,5-d][1,2,4]triazin-7-one
CID 71736662
acetylene;(E)-N,N-dimethyl-2-[2-methyl-5-(trifluoromethyl)pyrazolo[1,5-a]pyridin-3-yl]prop-1-en-1-amine;ethane;5-hydroxy-5-methylhexan-3-one
CID 168979656
2-methoxy-2-methyl-8-[5-(trifluoromethyl)-3-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridin-2-yl]octan-4-one
CID 170081460
ethane;9-methyl-2,7-bis(trifluoromethyl)carbazole
CID 142508322
8-[3-(2-fluorophenyl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-2-hydroxy-2-methyloctan-4-one
CID 170081458
2-methoxy-5-[2-methyl-5-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-c]pyrimidin-3-yl]phenol
CID 142401381
[7-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]methanamine
CID 117258138

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 168979522) is 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine is Cc1nn2ccc(C(F)(F)F)cc2c1C1=CN(C)NN1.
What is the InChIKey of 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is FCTLRSXTSFISKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12F3N5/c1-7-11(9-6-19(2)18-16-9)10-5-8(12(13,14)15)3-4-20(10)17-7/h3-6,16,18H,1-2H3.
What are the key properties of 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 283.26 g/mol, XLogP of 1.91, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(3-methyl-1,2-dihydrotriazol-5-yl)-5-(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 168979522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).