[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone

C20H17F4N7O2 — CID 170332531

IUPAC[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
SMILESCC(C)(F)c1nnc(C(=O)N2CCc3[nH]cnc3C2c2cc3ccc(C(F)(F)F)cn3n2)o1
InChIInChI=1S/C20H17F4N7O2/c1-19(2,21)18-28-27-16(33-18)17(32)30-6-5-12-14(26-9-25-12)15(30)13-7-11-4-3-10(20(22,23)24)8-31(11)29-13/h3-4,7-9,15H,5-6H2,1-2H3,(H,25,26)
InChIKeyOFAFMLIJNYWWMD-UHFFFAOYSA-N
MW463.40 g/mol
LogP3.45
Rot. Bonds3

About [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone

[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (PubChem CID 170332531) has the molecular formula C20H17F4N7O2 and a molecular weight of 463.40 g/mol. Its IUPAC name is [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.

Molecular Properties

Compound Name[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
PubChem CID170332531
Molecular FormulaC20H17F4N7O2
Molecular Weight463.40 g/mol
Exact Mass463.14
IUPAC Name[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
SMILESCC(C)(F)c1nnc(C(=O)N2CCc3[nH]cnc3C2c2cc3ccc(C(F)(F)F)cn3n2)o1
InChIInChI=1S/C20H17F4N7O2/c1-19(2,21)18-28-27-16(33-18)17(32)30-6-5-12-14(26-9-25-12)15(30)13-7-11-4-3-10(20(22,23)24)8-31(11)29-13/h3-4,7-9,15H,5-6H2,1-2H3,(H,25,26)
InChIKeyOFAFMLIJNYWWMD-UHFFFAOYSA-N
XLogP3.45
TPSA105.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone with MolForge

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Related Compounds

[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[(4R)-4-(6-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170380326
[4-(4-bromopyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]methanone
CID 170334155
[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170333391
[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[(4R)-4-(4-methoxypyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 169165865
(5-tert-butyl-1,3,4-oxadiazol-2-yl)-[4-(5-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332828
(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-[4-(6-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170333371
(5-tert-butyl-1,3,4-oxadiazol-2-yl)-[(4S)-4-(7-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 169166263
[5-(2-hydroxypropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-(7-methylpyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332518
(5-tert-butyl-1,3,4-oxadiazol-2-yl)-[4-[4-(trifluoromethoxy)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332924
[2-(2-fluoropropan-2-yl)-1,3-oxazol-5-yl]-(4-pyrazolo[1,5-a]pyridin-2-yl-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 170332838
[2-(2-fluoropropan-2-yl)-1,3-oxazol-5-yl]-[(4S)-4-pyrazolo[1,5-a]pyridin-2-yl-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 169165334
(5-tert-butyl-1,3,4-oxadiazol-2-yl)-[4-(4-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332739

Frequently Asked Questions

What is the IUPAC name of [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
The IUPAC name of [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone (CID 170332531) is [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone.
What is the SMILES notation for [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
The canonical SMILES for [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is CC(C)(F)c1nnc(C(=O)N2CCc3[nH]cnc3C2c2cc3ccc(C(F)(F)F)cn3n2)o1.
What is the InChIKey of [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
The InChIKey is OFAFMLIJNYWWMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F4N7O2/c1-19(2,21)18-28-27-16(33-18)17(32)30-6-5-12-14(26-9-25-12)15(30)13-7-11-4-3-10(20(22,23)24)8-31(11)29-13/h3-4,7-9,15H,5-6H2,1-2H3,(H,25,26).
What are the key properties of [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone?
[5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone has a molecular weight of 463.40 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-fluoropropan-2-yl)-1,3,4-oxadiazol-2-yl]-[4-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone is sourced from PubChem (CID 170332531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).