N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide

C24H32N4O5S — CID 21389125

IUPACN-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide
SMILESCCC1CCN(NC(=O)NS(=O)(=O)c2ccccc2CCNC(=O)c2ccccc2OC)CC1
InChIInChI=1S/C24H32N4O5S/c1-3-18-13-16-28(17-14-18)26-24(30)27-34(31,32)22-11-7-4-8-19(22)12-15-25-23(29)20-9-5-6-10-21(20)33-2/h4-11,18H,3,12-17H2,1-2H3,(H,25,29)(H2,26,27,30)
InChIKeyFOSMSMIVCNFTQG-UHFFFAOYSA-N
MW488.61 g/mol
LogP2.69
Rot. Bonds9

About N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide

N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide (PubChem CID 21389125) has the molecular formula C24H32N4O5S and a molecular weight of 488.61 g/mol. Its IUPAC name is N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide
PubChem CID21389125
Molecular FormulaC24H32N4O5S
Molecular Weight488.61 g/mol
Exact Mass488.21
IUPAC NameN-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide
SMILESCCC1CCN(NC(=O)NS(=O)(=O)c2ccccc2CCNC(=O)c2ccccc2OC)CC1
InChIInChI=1S/C24H32N4O5S/c1-3-18-13-16-28(17-14-18)26-24(30)27-34(31,32)22-11-7-4-8-19(22)12-15-25-23(29)20-9-5-6-10-21(20)33-2/h4-11,18H,3,12-17H2,1-2H3,(H,25,29)(H2,26,27,30)
InChIKeyFOSMSMIVCNFTQG-UHFFFAOYSA-N
XLogP2.69
TPSA116.84 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500488.61
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide 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

2-ethoxy-N-[2-[2-[(4-methylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]benzamide
CID 21389080
N-[2-(2-methoxyphenyl)ethyl]-2-piperidin-1-ylsulfonylbenzamide
CID 55338519
2-methoxy-N-[2-(1-methylpiperidin-4-yl)ethyl]benzamide
CID 99970994
N-[2-(cyclopropylamino)ethyl]-2-methoxybenzamide
CID 62665285
N-[2-(2-methoxy-5-methylphenyl)ethyl]-2-piperidin-1-ylsulfonylbenzamide
CID 55396039
1-[2-(2-methoxyphenyl)ethyl]-3-(4-methylphenyl)sulfonylurea
CID 110754998
N-[(4-ethyl-1-phenylcyclohexyl)methyl]-2-methoxybenzamide
CID 142271522
N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-2-methoxybenzamide
CID 39614122
2-bromo-5-(cyclopropylsulfamoyl)-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 17484041
N-[2-(cycloheptylamino)ethyl]-2-methoxybenzamide
CID 81487134
N-[2-(2,2-dimethylpropanoylamino)ethyl]-2-methoxybenzamide
CID 108538118
2-methoxy-N-(2-methylsulfonylethyl)benzamide
CID 47230081

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide?
The IUPAC name of N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide (CID 21389125) is N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide?
The canonical SMILES for N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide is CCC1CCN(NC(=O)NS(=O)(=O)c2ccccc2CCNC(=O)c2ccccc2OC)CC1.
What is the InChIKey of N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide?
The InChIKey is FOSMSMIVCNFTQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N4O5S/c1-3-18-13-16-28(17-14-18)26-24(30)27-34(31,32)22-11-7-4-8-19(22)12-15-25-23(29)20-9-5-6-10-21(20)33-2/h4-11,18H,3,12-17H2,1-2H3,(H,25,29)(H2,26,27,30).
What are the key properties of N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide?
N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide has a molecular weight of 488.61 g/mol, XLogP of 2.69, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[(4-ethylpiperidin-1-yl)carbamoylsulfamoyl]phenyl]ethyl]-2-methoxybenzamide is sourced from PubChem (CID 21389125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).