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

C20H16ClF2N7O2 — CID 170332486

IUPAC[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone
SMILESO=C(c1nnc(C2CC(F)(F)C2)o1)N1CCc2[nH]cnc2C1c1cc2cccc(Cl)n2n1
InChIInChI=1S/C20H16ClF2N7O2/c21-14-3-1-2-11-6-13(28-30(11)14)16-15-12(24-9-25-15)4-5-29(16)19(31)18-27-26-17(32-18)10-7-20(22,23)8-10/h1-3,6,9-10,16H,4-5,7-8H2,(H,24,25)
InChIKeyOAVFBNIXZQFRAI-UHFFFAOYSA-N
MW459.84 g/mol
LogP3.39
Rot. Bonds3

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

[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone (PubChem CID 170332486) has the molecular formula C20H16ClF2N7O2 and a molecular weight of 459.84 g/mol. Its IUPAC name is [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone.

Molecular Properties

Compound Name[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone
PubChem CID170332486
Molecular FormulaC20H16ClF2N7O2
Molecular Weight459.84 g/mol
Exact Mass459.10
IUPAC Name[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone
SMILESO=C(c1nnc(C2CC(F)(F)C2)o1)N1CCc2[nH]cnc2C1c1cc2cccc(Cl)n2n1
InChIInChI=1S/C20H16ClF2N7O2/c21-14-3-1-2-11-6-13(28-30(11)14)16-15-12(24-9-25-15)4-5-29(16)19(31)18-27-26-17(32-18)10-7-20(22,23)8-10/h1-3,6,9-10,16H,4-5,7-8H2,(H,24,25)
InChIKeyOAVFBNIXZQFRAI-UHFFFAOYSA-N
XLogP3.39
TPSA105.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.84
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)methanone
CID 170332236
[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)methanone
CID 170333741
[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]-[4-(4-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332434
[(4S)-4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-[1-(difluoromethyl)pyrazol-4-yl]-1,3,4-oxadiazol-2-yl]methanone
CID 169165045
[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(1,3-oxazol-5-yl)methanone
CID 170333548
[(4R)-4-(7-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)methanone
CID 169166392
(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-(4-pyrazolo[1,5-a]pyridin-2-yl-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl)methanone
CID 170332771
(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-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-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
[(4R)-4-(7-fluoropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)methanone
CID 169165161
[5-(1-methylcyclopropyl)-1,3,4-oxadiazol-2-yl]-[4-[7-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]methanone
CID 170332935

Frequently Asked Questions

What is the IUPAC name of [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone?
The IUPAC name of [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone (CID 170332486) is [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone.
What is the SMILES notation for [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone?
The canonical SMILES for [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone is O=C(c1nnc(C2CC(F)(F)C2)o1)N1CCc2[nH]cnc2C1c1cc2cccc(Cl)n2n1.
What is the InChIKey of [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone?
The InChIKey is OAVFBNIXZQFRAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClF2N7O2/c21-14-3-1-2-11-6-13(28-30(11)14)16-15-12(24-9-25-15)4-5-29(16)19(31)18-27-26-17(32-18)10-7-20(22,23)8-10/h1-3,6,9-10,16H,4-5,7-8H2,(H,24,25).
What are the key properties of [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone?
[4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone has a molecular weight of 459.84 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(7-chloropyrazolo[1,5-a]pyridin-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-5-yl]-[5-(3,3-difluorocyclobutyl)-1,3,4-oxadiazol-2-yl]methanone is sourced from PubChem (CID 170332486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).