N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide

C23H31N3O4S — CID 43044286

IUPACN-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide
SMILESCC(C)CC(CNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C23H31N3O4S/c1-18(2)16-21(26-12-14-30-15-13-26)17-24-23(27)19-8-10-22(11-9-19)31(28,29)25-20-6-4-3-5-7-20/h3-11,18,21,25H,12-17H2,1-2H3,(H,24,27)
InChIKeyQQXCYVTVTYNGSJ-UHFFFAOYSA-N
MW445.59 g/mol
LogP2.96
Rot. Bonds9

About N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide

N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide (PubChem CID 43044286) has the molecular formula C23H31N3O4S and a molecular weight of 445.59 g/mol. Its IUPAC name is N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide
PubChem CID43044286
Molecular FormulaC23H31N3O4S
Molecular Weight445.59 g/mol
Exact Mass445.20
IUPAC NameN-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide
SMILESCC(C)CC(CNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C23H31N3O4S/c1-18(2)16-21(26-12-14-30-15-13-26)17-24-23(27)19-8-10-22(11-9-19)31(28,29)25-20-6-4-3-5-7-20/h3-11,18,21,25H,12-17H2,1-2H3,(H,24,27)
InChIKeyQQXCYVTVTYNGSJ-UHFFFAOYSA-N
XLogP2.96
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500445.59
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(methanesulfonamido)-N-[(2R)-4-methyl-2-morpholin-4-ylpentyl]benzamide
CID 25331278
4-[(2,5-dimethylphenyl)sulfonylamino]-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 43044296
N-(4-methyl-2-morpholin-4-ylpentyl)-4-(4-methylpiperidin-1-yl)sulfonylbenzamide
CID 24633664
4-(2,6-dimethylmorpholin-4-yl)sulfonyl-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 43050167
N-[4-[(4-methyl-2-morpholin-4-ylpentyl)sulfamoyl]phenyl]acetamide
CID 110403337
4-(difluoromethoxy)-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 134027068
6-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 43050246
6-chloro-N-(4-methyl-2-morpholin-4-ylpentyl)pyridine-3-carboxamide
CID 134027027
4-[(4-methyl-2-morpholin-4-ylpentyl)carbamoylamino]-N-prop-2-enylbenzamide
CID 55834797
3-methyl-N-[(2R)-4-methyl-2-morpholin-4-ylpentyl]-4-nitrobenzamide
CID 30470681
N-(4-methyl-2-morpholin-4-ylpentyl)-3-phenylmethoxybenzamide
CID 46540846
2-methoxy-N-(4-methyl-2-morpholin-4-ylpentyl)benzamide
CID 110403268

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide?
The IUPAC name of N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide (CID 43044286) is N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide.
What is the SMILES notation for N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide?
The canonical SMILES for N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide is CC(C)CC(CNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)N1CCOCC1.
What is the InChIKey of N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide?
The InChIKey is QQXCYVTVTYNGSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O4S/c1-18(2)16-21(26-12-14-30-15-13-26)17-24-23(27)19-8-10-22(11-9-19)31(28,29)25-20-6-4-3-5-7-20/h3-11,18,21,25H,12-17H2,1-2H3,(H,24,27).
What are the key properties of N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide?
N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide has a molecular weight of 445.59 g/mol, XLogP of 2.96, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-morpholin-4-ylpentyl)-4-(phenylsulfamoyl)benzamide is sourced from PubChem (CID 43044286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).