2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide

C18H15N3O2 — CID 52898614

IUPAC2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide
SMILESO=C(Nc1cccc2ncccc12)c1cc2c([nH]c1=O)CCC2
InChIInChI=1S/C18H15N3O2/c22-17-13(10-11-4-1-6-14(11)20-17)18(23)21-16-8-2-7-15-12(16)5-3-9-19-15/h2-3,5,7-10H,1,4,6H2,(H,20,22)(H,21,23)
InChIKeyHOBRJBXWFWBLCC-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.66
Rot. Bonds2

About 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide

2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide (PubChem CID 52898614) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide
PubChem CID52898614
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Name2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide
SMILESO=C(Nc1cccc2ncccc12)c1cc2c([nH]c1=O)CCC2
InChIInChI=1S/C18H15N3O2/c22-17-13(10-11-4-1-6-14(11)20-17)18(23)21-16-8-2-7-15-12(16)5-3-9-19-15/h2-3,5,7-10H,1,4,6H2,(H,20,22)(H,21,23)
InChIKeyHOBRJBXWFWBLCC-UHFFFAOYSA-N
XLogP2.66
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide?
The IUPAC name of 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide (CID 52898614) is 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide?
The canonical SMILES for 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide is O=C(Nc1cccc2ncccc12)c1cc2c([nH]c1=O)CCC2.
What is the InChIKey of 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide?
The InChIKey is HOBRJBXWFWBLCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-17-13(10-11-4-1-6-14(11)20-17)18(23)21-16-8-2-7-15-12(16)5-3-9-19-15/h2-3,5,7-10H,1,4,6H2,(H,20,22)(H,21,23).
What are the key properties of 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide?
2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide has a molecular weight of 305.34 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-quinolin-5-yl-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxamide is sourced from PubChem (CID 52898614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).