4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide

C30H30N6O2 — CID 10458865

IUPAC4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide
SMILESCc1cccc(-c2nn3ccccc3c2-c2ccnc3cc(C(=O)NCCCN4CCOCC4)ccc23)n1
InChIInChI=1S/C30H30N6O2/c1-21-6-4-7-25(33-21)29-28(27-8-2-3-15-36(27)34-29)24-11-13-31-26-20-22(9-10-23(24)26)30(37)32-12-5-14-35-16-18-38-19-17-35/h2-4,6-11,13,15,20H,5,12,14,16-19H2,1H3,(H,32,37)
InChIKeyUXEZOXFIEDQEDM-UHFFFAOYSA-N
MW506.61 g/mol
LogP4.37
Rot. Bonds7

About 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide

4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide (PubChem CID 10458865) has the molecular formula C30H30N6O2 and a molecular weight of 506.61 g/mol. Its IUPAC name is 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide.

Molecular Properties

Compound Name4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide
PubChem CID10458865
Molecular FormulaC30H30N6O2
Molecular Weight506.61 g/mol
Exact Mass506.24
IUPAC Name4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide
SMILESCc1cccc(-c2nn3ccccc3c2-c2ccnc3cc(C(=O)NCCCN4CCOCC4)ccc23)n1
InChIInChI=1S/C30H30N6O2/c1-21-6-4-7-25(33-21)29-28(27-8-2-3-15-36(27)34-29)24-11-13-31-26-20-22(9-10-23(24)26)30(37)32-12-5-14-35-16-18-38-19-17-35/h2-4,6-11,13,15,20H,5,12,14,16-19H2,1H3,(H,32,37)
InChIKeyUXEZOXFIEDQEDM-UHFFFAOYSA-N
XLogP4.37
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500506.61
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide?
The IUPAC name of 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide (CID 10458865) is 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide.
What is the SMILES notation for 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide?
The canonical SMILES for 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide is Cc1cccc(-c2nn3ccccc3c2-c2ccnc3cc(C(=O)NCCCN4CCOCC4)ccc23)n1.
What is the InChIKey of 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide?
The InChIKey is UXEZOXFIEDQEDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30N6O2/c1-21-6-4-7-25(33-21)29-28(27-8-2-3-15-36(27)34-29)24-11-13-31-26-20-22(9-10-23(24)26)30(37)32-12-5-14-35-16-18-38-19-17-35/h2-4,6-11,13,15,20H,5,12,14,16-19H2,1H3,(H,32,37).
What are the key properties of 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide?
4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide has a molecular weight of 506.61 g/mol, XLogP of 4.37, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(6-methyl-2-pyridinyl)pyrazolo[1,5-a]pyridin-3-yl]-N-(3-morpholin-4-ylpropyl)quinoline-7-carboxamide is sourced from PubChem (CID 10458865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).