5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide

C20H24N2O4S — CID 24980506

IUPAC5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide
SMILESCc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NCC1CCCO1
InChIInChI=1S/C20H24N2O4S/c1-15-9-10-18(27(24,25)22-13-16-6-3-2-4-7-16)12-19(15)20(23)21-14-17-8-5-11-26-17/h2-4,6-7,9-10,12,17,22H,5,8,11,13-14H2,1H3,(H,21,23)
InChIKeyXASJVNHXAPIFBK-UHFFFAOYSA-N
MW388.49 g/mol
LogP2.38
Rot. Bonds7

About 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide

5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide (PubChem CID 24980506) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide
PubChem CID24980506
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide
SMILESCc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NCC1CCCO1
InChIInChI=1S/C20H24N2O4S/c1-15-9-10-18(27(24,25)22-13-16-6-3-2-4-7-16)12-19(15)20(23)21-14-17-8-5-11-26-17/h2-4,6-7,9-10,12,17,22H,5,8,11,13-14H2,1H3,(H,21,23)
InChIKeyXASJVNHXAPIFBK-UHFFFAOYSA-N
XLogP2.38
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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[2-Methyl-5-(morpholine-4-sulfonyl)-phenyl]-pyrrolidin-1-yl-methanone
CID 6459647
N,N-dimethyl-3-[4-(oxolane-2-carbonyl)piperazine-1-carbonyl]benzenesulfonamide
CID 16278252
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CID 18582819
n-(2-Methoxyethyl)-4-sulfamoylbenzamide
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Indeno[1,2-c]isoquinolinone, 14
CID 11157496
N-Cyclopentyl-2-methyl-5-(morpholine-4-sulfonyl)-benzamide
CID 1087796
3-{4-[(benzylamino)sulfonyl]phenyl}-N-(tetrahydro-2-furanylmethyl)propanamide
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3-[(dimethylamino)sulfonyl]-N-(tetrahydro-2-furanylmethyl)benzamide
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CID 2998789

Frequently Asked Questions

What is the IUPAC name of 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide?
The IUPAC name of 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide (CID 24980506) is 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide.
What is the SMILES notation for 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide?
The canonical SMILES for 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide is Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NCC1CCCO1.
What is the InChIKey of 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide?
The InChIKey is XASJVNHXAPIFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-15-9-10-18(27(24,25)22-13-16-6-3-2-4-7-16)12-19(15)20(23)21-14-17-8-5-11-26-17/h2-4,6-7,9-10,12,17,22H,5,8,11,13-14H2,1H3,(H,21,23).
What are the key properties of 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide?
5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide has a molecular weight of 388.49 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzylsulfamoyl)-2-methyl-N-(oxolan-2-ylmethyl)benzamide is sourced from PubChem (CID 24980506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).