4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine

C20H17F3N6 — CID 170332981

IUPAC4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCc1cccc2cc(C3c4nc[nH]c4CCN3c3ccc(C(F)(F)F)cn3)nn12
InChIInChI=1S/C20H17F3N6/c1-12-3-2-4-14-9-16(27-29(12)14)19-18-15(25-11-26-18)7-8-28(19)17-6-5-13(10-24-17)20(21,22)23/h2-6,9-11,19H,7-8H2,1H3,(H,25,26)
InChIKeyXZIRNPXYOFMDQA-UHFFFAOYSA-N
MW398.39 g/mol
LogP3.93
Rot. Bonds2

About 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine

4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 170332981) has the molecular formula C20H17F3N6 and a molecular weight of 398.39 g/mol. Its IUPAC name is 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID170332981
Molecular FormulaC20H17F3N6
Molecular Weight398.39 g/mol
Exact Mass398.15
IUPAC Name4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCc1cccc2cc(C3c4nc[nH]c4CCN3c3ccc(C(F)(F)F)cn3)nn12
InChIInChI=1S/C20H17F3N6/c1-12-3-2-4-14-9-16(27-29(12)14)19-18-15(25-11-26-18)7-8-28(19)17-6-5-13(10-24-17)20(21,22)23/h2-6,9-11,19H,7-8H2,1H3,(H,25,26)
InChIKeyXZIRNPXYOFMDQA-UHFFFAOYSA-N
XLogP3.93
TPSA62.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4R)-4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 170196870
(4R)-4-(4-chloropyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 169165758
2-(1,1-difluoroethyl)-5-[(4R)-4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole
CID 169166198
2-(difluoromethyl)-5-[4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole
CID 170333091
2-(4-fluorophenyl)-5-[(4R)-4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole
CID 169166450
(4R)-4-(1-benzofuran-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 169164064
2-[4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-5-pyridin-2-yl-1,3,4-oxadiazole
CID 170332754
2-[(4R)-4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-5-(2-methyl-3-pyridinyl)-1,3,4-oxadiazole
CID 169165766
(4R)-5-(5-tert-butylpyrimidin-2-yl)-4-(4,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 176928688
(4-methyl-1,3-oxazol-5-yl)-[4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332547
(4R)-4-pyrazolo[1,5-a]pyridin-2-yl-5-[6-(trifluoromethyl)pyrazin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 176928322
2-(3-methyl-2-pyridinyl)-5-[(4R)-4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-1,3,4-oxadiazole
CID 169165200

Frequently Asked Questions

What is the IUPAC name of 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 170332981) is 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine is Cc1cccc2cc(C3c4nc[nH]c4CCN3c3ccc(C(F)(F)F)cn3)nn12.
What is the InChIKey of 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is XZIRNPXYOFMDQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F3N6/c1-12-3-2-4-14-9-16(27-29(12)14)19-18-15(25-11-26-18)7-8-28(19)17-6-5-13(10-24-17)20(21,22)23/h2-6,9-11,19H,7-8H2,1H3,(H,25,26).
What are the key properties of 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine?
4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 398.39 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-5-[5-(trifluoromethyl)-2-pyridinyl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 170332981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).