4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine

C13H9N3O3 — CID 118197918

IUPAC4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine
SMILESO=[N+]([O-])c1ccc(Oc2cccn3nccc23)cc1
InChIInChI=1S/C13H9N3O3/c17-16(18)10-3-5-11(6-4-10)19-13-2-1-9-15-12(13)7-8-14-15/h1-9H
InChIKeyPOOZWGPLXSKZEO-UHFFFAOYSA-N
MW255.23 g/mol
LogP3.03
Rot. Bonds3

About 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine

4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine (PubChem CID 118197918) has the molecular formula C13H9N3O3 and a molecular weight of 255.23 g/mol. Its IUPAC name is 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine
PubChem CID118197918
Molecular FormulaC13H9N3O3
Molecular Weight255.23 g/mol
Exact Mass255.06
IUPAC Name4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine
SMILESO=[N+]([O-])c1ccc(Oc2cccn3nccc23)cc1
InChIInChI=1S/C13H9N3O3/c17-16(18)10-3-5-11(6-4-10)19-13-2-1-9-15-12(13)7-8-14-15/h1-9H
InChIKeyPOOZWGPLXSKZEO-UHFFFAOYSA-N
XLogP3.03
TPSA69.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(4-nitrophenoxy)pyrrolo[1,2-b]pyridazine
CID 58190627
4-(4-nitrophenyl)pyrazolo[1,5-a]pyrazine
CID 139599922
2-(4-nitrophenoxy)cyclohepta-2,4,6-trien-1-one
CID 71333814
2-(4-nitrophenoxy)benzoic acid
CID 139059188
1-[2-(4-nitrophenoxy)phenyl]ethanone
CID 7040232
[2-(4-nitrophenoxy)phenyl]phosphonic acid
CID 170987908
1-[1,1,1,3,3,3-hexafluoro-2-[2-(4-nitrophenoxy)phenyl]propan-2-yl]-2-(4-nitrophenoxy)benzene
CID 139816676
N-methyl-1-[2-(4-nitrophenoxy)phenyl]methanamine
CID 54915610
1,6-bis(4-nitrophenoxy)naphthalene
CID 54368809
2,4-difluoro-1-(4-nitrophenoxy)benzene
CID 3015409
ethane;3-iodo-4-(4-nitrophenoxy)pyridine
CID 91494066
2-methyl-4-(4-nitrophenoxy)furo[2,3-b]pyridine
CID 58272180

Frequently Asked Questions

What is the IUPAC name of 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine?
The IUPAC name of 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine (CID 118197918) is 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine is O=[N+]([O-])c1ccc(Oc2cccn3nccc23)cc1.
What is the InChIKey of 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine?
The InChIKey is POOZWGPLXSKZEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O3/c17-16(18)10-3-5-11(6-4-10)19-13-2-1-9-15-12(13)7-8-14-15/h1-9H.
What are the key properties of 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine?
4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine has a molecular weight of 255.23 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-nitrophenoxy)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 118197918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).