N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide

C34H26F2N6O4 — CID 118203883

IUPACN-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(Oc2cc(-c3ccc(N4CCOCC4)nc3)cn3nccc23)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C34H26F2N6O4/c35-24-4-7-26(8-5-24)41-13-1-2-27(34(41)44)33(43)39-25-6-9-30(28(36)19-25)46-31-18-23(21-42-29(31)11-12-38-42)22-3-10-32(37-20-22)40-14-16-45-17-15-40/h1-13,18-21H,14-17H2,(H,39,43)
InChIKeyOUXRPCSDQWNBAP-UHFFFAOYSA-N
MW620.62 g/mol
LogP5.71
Rot. Bonds7

About N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide

N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide (PubChem CID 118203883) has the molecular formula C34H26F2N6O4 and a molecular weight of 620.62 g/mol. Its IUPAC name is N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
PubChem CID118203883
Molecular FormulaC34H26F2N6O4
Molecular Weight620.62 g/mol
Exact Mass620.20
IUPAC NameN-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide
SMILESO=C(Nc1ccc(Oc2cc(-c3ccc(N4CCOCC4)nc3)cn3nccc23)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O
InChIInChI=1S/C34H26F2N6O4/c35-24-4-7-26(8-5-24)41-13-1-2-27(34(41)44)33(43)39-25-6-9-30(28(36)19-25)46-31-18-23(21-42-29(31)11-12-38-42)22-3-10-32(37-20-22)40-14-16-45-17-15-40/h1-13,18-21H,14-17H2,(H,39,43)
InChIKeyOUXRPCSDQWNBAP-UHFFFAOYSA-N
XLogP5.71
TPSA102.99 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms46
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500620.62
LogP ≤ 55.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide?
The IUPAC name of N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide (CID 118203883) is N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide is O=C(Nc1ccc(Oc2cc(-c3ccc(N4CCOCC4)nc3)cn3nccc23)c(F)c1)c1cccn(-c2ccc(F)cc2)c1=O.
What is the InChIKey of N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide?
The InChIKey is OUXRPCSDQWNBAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26F2N6O4/c35-24-4-7-26(8-5-24)41-13-1-2-27(34(41)44)33(43)39-25-6-9-30(28(36)19-25)46-31-18-23(21-42-29(31)11-12-38-42)22-3-10-32(37-20-22)40-14-16-45-17-15-40/h1-13,18-21H,14-17H2,(H,39,43).
What are the key properties of N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide?
N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide has a molecular weight of 620.62 g/mol, XLogP of 5.71, 7 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-fluoro-4-[6-(6-morpholin-4-yl-3-pyridinyl)pyrazolo[1,5-a]pyridin-4-yl]oxyphenyl]-1-(4-fluorophenyl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 118203883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).