[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

C20H20FN7O3 — CID 169165865

IUPAC[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
SMILESCOc1cccn2nc([C@H]3c4nc[nH]c4CCN3C(=O)c3nnc(C(C)(C)F)o3)cc12
InChIInChI=1S/C20H20FN7O3/c1-20(2,21)19-25-24-17(31-19)18(29)27-8-6-11-15(23-10-22-11)16(27)12-9-13-14(30-3)5-4-7-28(13)26-12/h4-5,7,9-10,16H,6,8H2,1-3H3,(H,22,23)/t16-/m0/s1
InChIKeyDJUHPMVDJFOJTM-INIZCTEOSA-N
MW425.42 g/mol
LogP2.44
Rot. Bonds4

About [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

[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 (PubChem CID 169165865) has the molecular formula C20H20FN7O3 and a molecular weight of 425.42 g/mol. Its IUPAC name is [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.

Molecular Properties

Compound Name[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
PubChem CID169165865
Molecular FormulaC20H20FN7O3
Molecular Weight425.42 g/mol
Exact Mass425.16
IUPAC Name[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
SMILESCOc1cccn2nc([C@H]3c4nc[nH]c4CCN3C(=O)c3nnc(C(C)(C)F)o3)cc12
InChIInChI=1S/C20H20FN7O3/c1-20(2,21)19-25-24-17(31-19)18(29)27-8-6-11-15(23-10-22-11)16(27)12-9-13-14(30-3)5-4-7-28(13)26-12/h4-5,7,9-10,16H,6,8H2,1-3H3,(H,22,23)/t16-/m0/s1
InChIKeyDJUHPMVDJFOJTM-INIZCTEOSA-N
XLogP2.44
TPSA114.44 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.42
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze [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 with MolForge

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Related Compounds

[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-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
(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
(5-tert-butyl-1,3,4-oxadiazol-2-yl)-[(4S)-4-(4-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332732
[4-[4-(difluoromethoxy)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanone
CID 170332661
[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
[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
(5-methyl-1,3,4-oxadiazol-2-yl)-[4-[4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332974
[4-[4-(trifluoromethoxy)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-[1-(trifluoromethyl)pyrazol-3-yl]-1,3,4-oxadiazol-2-yl]methanone
CID 170332129
[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
[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-methyl-1,3,4-oxadiazol-2-yl)methanone
CID 170333525
(2,5-dimethyl-1,2,4-triazol-3-yl)-[(4S)-4-(4-methoxypyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 169166408

Frequently Asked Questions

What is the IUPAC name of [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?
The IUPAC name of [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) is [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.
What is the SMILES notation for [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?
The canonical SMILES for [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 is COc1cccn2nc([C@H]3c4nc[nH]c4CCN3C(=O)c3nnc(C(C)(C)F)o3)cc12.
What is the InChIKey of [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?
The InChIKey is DJUHPMVDJFOJTM-INIZCTEOSA-N. The full InChI is InChI=1S/C20H20FN7O3/c1-20(2,21)19-25-24-17(31-19)18(29)27-8-6-11-15(23-10-22-11)16(27)12-9-13-14(30-3)5-4-7-28(13)26-12/h4-5,7,9-10,16H,6,8H2,1-3H3,(H,22,23)/t16-/m0/s1.
What are the key properties of [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?
[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 has a molecular weight of 425.42 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [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 is sourced from PubChem (CID 169165865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).