7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide

C16H17N3O3 — CID 155528603

IUPAC7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NC3CCCNC3=O)cnc2c1
InChIInChI=1S/C16H17N3O3/c1-22-12-5-4-10-7-11(9-18-14(10)8-12)15(20)19-13-3-2-6-17-16(13)21/h4-5,7-9,13H,2-3,6H2,1H3,(H,17,21)(H,19,20)
InChIKeyOJIRFFVQOSTKKE-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.25
Rot. Bonds3

About 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide

7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide (PubChem CID 155528603) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide
PubChem CID155528603
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)NC3CCCNC3=O)cnc2c1
InChIInChI=1S/C16H17N3O3/c1-22-12-5-4-10-7-11(9-18-14(10)8-12)15(20)19-13-3-2-6-17-16(13)21/h4-5,7-9,13H,2-3,6H2,1H3,(H,17,21)(H,19,20)
InChIKeyOJIRFFVQOSTKKE-UHFFFAOYSA-N
XLogP1.25
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide?
The IUPAC name of 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide (CID 155528603) is 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide.
What is the SMILES notation for 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide?
The canonical SMILES for 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide is COc1ccc2cc(C(=O)NC3CCCNC3=O)cnc2c1.
What is the InChIKey of 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide?
The InChIKey is OJIRFFVQOSTKKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-22-12-5-4-10-7-11(9-18-14(10)8-12)15(20)19-13-3-2-6-17-16(13)21/h4-5,7-9,13H,2-3,6H2,1H3,(H,17,21)(H,19,20).
What are the key properties of 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide?
7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-(2-oxopiperidin-3-yl)quinoline-3-carboxamide is sourced from PubChem (CID 155528603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).