5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide

C26H26FN5O — CID 90094914

IUPAC5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc(-c2ncccc2-c2ccn3ncc(C(=O)NC4CCN(C)CC4)c3c2)ccc1F
InChIInChI=1S/C26H26FN5O/c1-17-14-19(5-6-23(17)27)25-21(4-3-10-28-25)18-7-13-32-24(15-18)22(16-29-32)26(33)30-20-8-11-31(2)12-9-20/h3-7,10,13-16,20H,8-9,11-12H2,1-2H3,(H,30,33)
InChIKeyPKQNWFFUPQEYCI-UHFFFAOYSA-N
MW443.53 g/mol
LogP4.33
Rot. Bonds4

About 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide

5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 90094914) has the molecular formula C26H26FN5O and a molecular weight of 443.53 g/mol. Its IUPAC name is 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID90094914
Molecular FormulaC26H26FN5O
Molecular Weight443.53 g/mol
Exact Mass443.21
IUPAC Name5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1cc(-c2ncccc2-c2ccn3ncc(C(=O)NC4CCN(C)CC4)c3c2)ccc1F
InChIInChI=1S/C26H26FN5O/c1-17-14-19(5-6-23(17)27)25-21(4-3-10-28-25)18-7-13-32-24(15-18)22(16-29-32)26(33)30-20-8-11-31(2)12-9-20/h3-7,10,13-16,20H,8-9,11-12H2,1-2H3,(H,30,33)
InChIKeyPKQNWFFUPQEYCI-UHFFFAOYSA-N
XLogP4.33
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.53
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 90094914) is 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1cc(-c2ncccc2-c2ccn3ncc(C(=O)NC4CCN(C)CC4)c3c2)ccc1F.
What is the InChIKey of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is PKQNWFFUPQEYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26FN5O/c1-17-14-19(5-6-23(17)27)25-21(4-3-10-28-25)18-7-13-32-24(15-18)22(16-29-32)26(33)30-20-8-11-31(2)12-9-20/h3-7,10,13-16,20H,8-9,11-12H2,1-2H3,(H,30,33).
What are the key properties of 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide?
5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 443.53 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N-(1-methylpiperidin-4-yl)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 90094914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).