N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide

C20H28N4O3S — CID 55544877

IUPACN,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide
SMILESCCN(CC)C(=O)CN1CCN(S(=O)(=O)c2ccc(C)c3ncccc23)CC1
InChIInChI=1S/C20H28N4O3S/c1-4-23(5-2)19(25)15-22-11-13-24(14-12-22)28(26,27)18-9-8-16(3)20-17(18)7-6-10-21-20/h6-10H,4-5,11-15H2,1-3H3
InChIKeySFZPEVRWEUSVMO-UHFFFAOYSA-N
MW404.54 g/mol
LogP1.72
Rot. Bonds6

About N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide

N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide (PubChem CID 55544877) has the molecular formula C20H28N4O3S and a molecular weight of 404.54 g/mol. Its IUPAC name is N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide
PubChem CID55544877
Molecular FormulaC20H28N4O3S
Molecular Weight404.54 g/mol
Exact Mass404.19
IUPAC NameN,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide
SMILESCCN(CC)C(=O)CN1CCN(S(=O)(=O)c2ccc(C)c3ncccc23)CC1
InChIInChI=1S/C20H28N4O3S/c1-4-23(5-2)19(25)15-22-11-13-24(14-12-22)28(26,27)18-9-8-16(3)20-17(18)7-6-10-21-20/h6-10H,4-5,11-15H2,1-3H3
InChIKeySFZPEVRWEUSVMO-UHFFFAOYSA-N
XLogP1.72
TPSA73.82 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.54
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

1-(azepan-1-yl)-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]ethanone
CID 55560037
N-(2-chlorophenyl)-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide
CID 55558830
5-(4-benzylpiperazin-1-yl)sulfonyl-8-methylquinoline
CID 46634669
5-(3-chloropyrrolidin-1-yl)sulfonyl-8-methylquinoline
CID 104774152
3-ethyl-1-(8-methylquinolin-5-yl)sulfonylazetidin-3-ol
CID 104774002
N,N-diethyl-2-[4-(3-methylquinolin-8-yl)sulfonylpiperazin-1-yl]acetamide
CID 33346978
[1-(8-methylquinolin-5-yl)sulfonylpiperidin-4-yl]methanamine;hydrochloride
CID 119963849
1-[1-(8-methylquinolin-5-yl)sulfonylpiperidin-4-yl]ethanamine
CID 119974886
N,N-diethyl-2-[4-(4-methyl-3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide
CID 24525780
2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N,N-diethylacetamide
CID 78787610
2-[(8-methylquinolin-5-yl)sulfonylamino]butanoic acid
CID 104773542
(2R)-2-[(8-methylquinolin-5-yl)sulfonylamino]butanoic acid
CID 103862690

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide?
The IUPAC name of N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide (CID 55544877) is N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide.
What is the SMILES notation for N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide?
The canonical SMILES for N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide is CCN(CC)C(=O)CN1CCN(S(=O)(=O)c2ccc(C)c3ncccc23)CC1.
What is the InChIKey of N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide?
The InChIKey is SFZPEVRWEUSVMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O3S/c1-4-23(5-2)19(25)15-22-11-13-24(14-12-22)28(26,27)18-9-8-16(3)20-17(18)7-6-10-21-20/h6-10H,4-5,11-15H2,1-3H3.
What are the key properties of N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide?
N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide has a molecular weight of 404.54 g/mol, XLogP of 1.72, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[4-(8-methylquinolin-5-yl)sulfonylpiperazin-1-yl]acetamide is sourced from PubChem (CID 55544877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).