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

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Related Compounds

2-[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]-3H-benzimidazole-5-carboxamide
CID 10113332
4-[6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrazin-2-yl]benzamide
CID 6482931
ethyl 3-[4-(4-methoxyphenyl)piperazin-1-yl]quinoxaline-2-carboxylate
CID 50765029
6-[4-(4-methoxyphenyl)piperazin-1-yl]pyridine-2-carboxamide
CID 173099499
7-methoxy-3-methyl-2-piperazin-1-ylquinoline;hydrochloride
CID 121237209
2-(4-hydroxypiperidin-1-yl)-6-methoxyquinoline-3-carbonitrile
CID 650445
3-(4-formylpiperidin-1-yl)benzoic acid;4-methoxybenzamide
CID 153403453
[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl] 2-chloroquinoline-6-carboxylate
CID 55730088
4-[[cyclopropyl-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]amino]methyl]benzamide
CID 46567938
4-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]benzamide
CID 75524435
3-bromo-6-methoxyquinoline-2-carboxamide
CID 173087075
6-methoxy-1-methylpyrazolo[5,4-b]quinoline-3-carboxamide
CID 14822502

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).