4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine

C26H21FN4O — CID 10137164

IUPAC4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
SMILESCOc1ccc(CNc2cc(-c3c(-c4ccc(F)cc4)nn4ccccc34)ccn2)cc1
InChIInChI=1S/C26H21FN4O/c1-32-22-11-5-18(6-12-22)17-29-24-16-20(13-14-28-24)25-23-4-2-3-15-31(23)30-26(25)19-7-9-21(27)10-8-19/h2-16H,17H2,1H3,(H,28,29)
InChIKeyKHZCVTZQXFCBEM-UHFFFAOYSA-N
MW424.48 g/mol
LogP5.82
Rot. Bonds6

About 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine

4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine (PubChem CID 10137164) has the molecular formula C26H21FN4O and a molecular weight of 424.48 g/mol. Its IUPAC name is 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
PubChem CID10137164
Molecular FormulaC26H21FN4O
Molecular Weight424.48 g/mol
Exact Mass424.17
IUPAC Name4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
SMILESCOc1ccc(CNc2cc(-c3c(-c4ccc(F)cc4)nn4ccccc34)ccn2)cc1
InChIInChI=1S/C26H21FN4O/c1-32-22-11-5-18(6-12-22)17-29-24-16-20(13-14-28-24)25-23-4-2-3-15-31(23)30-26(25)19-7-9-21(27)10-8-19/h2-16H,17H2,1H3,(H,28,29)
InChIKeyKHZCVTZQXFCBEM-UHFFFAOYSA-N
XLogP5.82
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500424.48
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 72202474
CID 72202474
CID 121412508
CID 121412508
CID 118958833
CID 118958833
CID 74223726
CID 74223726
CID 58223272
CID 58223272
CID 50997747
CID 50997747
CID 6539389
CID 6539389
CID 44577753
CID 44577753
CID 56835771
CID 56835771
CID 5329457
CID 5329457
CID 5329458
CID 5329458
CID 6539361
CID 6539361

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine?
The IUPAC name of 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine (CID 10137164) is 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine.
What is the SMILES notation for 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine?
The canonical SMILES for 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine is COc1ccc(CNc2cc(-c3c(-c4ccc(F)cc4)nn4ccccc34)ccn2)cc1.
What is the InChIKey of 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine?
The InChIKey is KHZCVTZQXFCBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21FN4O/c1-32-22-11-5-18(6-12-22)17-29-24-16-20(13-14-28-24)25-23-4-2-3-15-31(23)30-26(25)19-7-9-21(27)10-8-19/h2-16H,17H2,1H3,(H,28,29).
What are the key properties of 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine?
4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine has a molecular weight of 424.48 g/mol, XLogP of 5.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridin-3-yl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine is sourced from PubChem (CID 10137164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).