2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide

C22H19N3O3 — CID 110616680

IUPAC2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
SMILESCc1cc2cc(CC(=O)NCc3cc4ccccc4[nH]c3=O)ccc2[nH]c1=O
InChIInChI=1S/C22H19N3O3/c1-13-8-16-9-14(6-7-19(16)24-21(13)27)10-20(26)23-12-17-11-15-4-2-3-5-18(15)25-22(17)28/h2-9,11H,10,12H2,1H3,(H,23,26)(H,24,27)(H,25,28)
InChIKeyKOPVDMFZMUCRPF-UHFFFAOYSA-N
MW373.41 g/mol
LogP2.54
Rot. Bonds4

About 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide

2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide (PubChem CID 110616680) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
PubChem CID110616680
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC Name2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
SMILESCc1cc2cc(CC(=O)NCc3cc4ccccc4[nH]c3=O)ccc2[nH]c1=O
InChIInChI=1S/C22H19N3O3/c1-13-8-16-9-14(6-7-19(16)24-21(13)27)10-20(26)23-12-17-11-15-4-2-3-5-18(15)25-22(17)28/h2-9,11H,10,12H2,1H3,(H,23,26)(H,24,27)(H,25,28)
InChIKeyKOPVDMFZMUCRPF-UHFFFAOYSA-N
XLogP2.54
TPSA94.82 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 52.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide 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 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The IUPAC name of 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide (CID 110616680) is 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide.
What is the SMILES notation for 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The canonical SMILES for 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide is Cc1cc2cc(CC(=O)NCc3cc4ccccc4[nH]c3=O)ccc2[nH]c1=O.
What is the InChIKey of 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The InChIKey is KOPVDMFZMUCRPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c1-13-8-16-9-14(6-7-19(16)24-21(13)27)10-20(26)23-12-17-11-15-4-2-3-5-18(15)25-22(17)28/h2-9,11H,10,12H2,1H3,(H,23,26)(H,24,27)(H,25,28).
What are the key properties of 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide?
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide has a molecular weight of 373.41 g/mol, XLogP of 2.54, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide is sourced from PubChem (CID 110616680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).