4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide

C22H24N4O2 — CID 75442529

IUPAC4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide
SMILESCOc1ccc2nc(N3CCN(c4ccc(C(N)=O)cc4)CC3)c(C)cc2c1
InChIInChI=1S/C22H24N4O2/c1-15-13-17-14-19(28-2)7-8-20(17)24-22(15)26-11-9-25(10-12-26)18-5-3-16(4-6-18)21(23)27/h3-8,13-14H,9-12H2,1-2H3,(H2,23,27)
InChIKeyUDRWGBLVWKITBS-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.98
Rot. Bonds4

About 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide

4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide (PubChem CID 75442529) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide.

Molecular Properties

Compound Name4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide
PubChem CID75442529
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide
SMILESCOc1ccc2nc(N3CCN(c4ccc(C(N)=O)cc4)CC3)c(C)cc2c1
InChIInChI=1S/C22H24N4O2/c1-15-13-17-14-19(28-2)7-8-20(17)24-22(15)26-11-9-25(10-12-26)18-5-3-16(4-6-18)21(23)27/h3-8,13-14H,9-12H2,1-2H3,(H2,23,27)
InChIKeyUDRWGBLVWKITBS-UHFFFAOYSA-N
XLogP2.98
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide 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 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide?
The IUPAC name of 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide (CID 75442529) is 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide.
What is the SMILES notation for 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide?
The canonical SMILES for 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide is COc1ccc2nc(N3CCN(c4ccc(C(N)=O)cc4)CC3)c(C)cc2c1.
What is the InChIKey of 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide?
The InChIKey is UDRWGBLVWKITBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-15-13-17-14-19(28-2)7-8-20(17)24-22(15)26-11-9-25(10-12-26)18-5-3-16(4-6-18)21(23)27/h3-8,13-14H,9-12H2,1-2H3,(H2,23,27).
What are the key properties of 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide?
4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide has a molecular weight of 376.46 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-methoxy-3-methylquinolin-2-yl)piperazin-1-yl]benzamide is sourced from PubChem (CID 75442529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).