7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine

C25H22FN5O — CID 70879655

IUPAC7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine
SMILESCOc1cccc(-c2cc(C)cc3c(-c4ncc(-n5cccn5)cc4C)c(C)nn23)c1F
InChIInChI=1S/C25H22FN5O/c1-15-11-20(19-7-5-8-22(32-4)24(19)26)31-21(12-15)23(17(3)29-31)25-16(2)13-18(14-27-25)30-10-6-9-28-30/h5-14H,1-4H3
InChIKeyYIDZMIQBGSNVSF-UHFFFAOYSA-N
MW427.48 g/mol
LogP5.32
Rot. Bonds4

About 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine

7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine (PubChem CID 70879655) has the molecular formula C25H22FN5O and a molecular weight of 427.48 g/mol. Its IUPAC name is 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine
PubChem CID70879655
Molecular FormulaC25H22FN5O
Molecular Weight427.48 g/mol
Exact Mass427.18
IUPAC Name7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine
SMILESCOc1cccc(-c2cc(C)cc3c(-c4ncc(-n5cccn5)cc4C)c(C)nn23)c1F
InChIInChI=1S/C25H22FN5O/c1-15-11-20(19-7-5-8-22(32-4)24(19)26)31-21(12-15)23(17(3)29-31)25-16(2)13-18(14-27-25)30-10-6-9-28-30/h5-14H,1-4H3
InChIKeyYIDZMIQBGSNVSF-UHFFFAOYSA-N
XLogP5.32
TPSA57.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500427.48
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine (CID 70879655) is 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine is COc1cccc(-c2cc(C)cc3c(-c4ncc(-n5cccn5)cc4C)c(C)nn23)c1F.
What is the InChIKey of 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine?
The InChIKey is YIDZMIQBGSNVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22FN5O/c1-15-11-20(19-7-5-8-22(32-4)24(19)26)31-21(12-15)23(17(3)29-31)25-16(2)13-18(14-27-25)30-10-6-9-28-30/h5-14H,1-4H3.
What are the key properties of 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine?
7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine has a molecular weight of 427.48 g/mol, XLogP of 5.32, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-fluoro-3-methoxyphenyl)-2,5-dimethyl-3-(3-methyl-5-pyrazol-1-yl-2-pyridinyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 70879655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).