2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide

C15H24N2O4S — CID 43019463

IUPAC2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)NC(C)CCC(C)C
InChIInChI=1S/C15H24N2O4S/c1-10(2)5-6-11(3)17-15(18)13-9-12(22(16,19)20)7-8-14(13)21-4/h7-11H,5-6H2,1-4H3,(H,17,18)(H2,16,19,20)
InChIKeyGOAAYTTVSATFCA-UHFFFAOYSA-N
MW328.43 g/mol
LogP1.90
Rot. Bonds7

About 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide

2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide (PubChem CID 43019463) has the molecular formula C15H24N2O4S and a molecular weight of 328.43 g/mol. Its IUPAC name is 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide.

Molecular Properties

Compound Name2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide
PubChem CID43019463
Molecular FormulaC15H24N2O4S
Molecular Weight328.43 g/mol
Exact Mass328.15
IUPAC Name2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide
SMILESCOc1ccc(S(N)(=O)=O)cc1C(=O)NC(C)CCC(C)C
InChIInChI=1S/C15H24N2O4S/c1-10(2)5-6-11(3)17-15(18)13-9-12(22(16,19)20)7-8-14(13)21-4/h7-11H,5-6H2,1-4H3,(H,17,18)(H2,16,19,20)
InChIKeyGOAAYTTVSATFCA-UHFFFAOYSA-N
XLogP1.90
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.43
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[(2R)-octan-2-yl]-5-sulfamoylbenzamide
CID 38280263
2-bromo-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide
CID 42940827
2-methoxy-N-[2-(methylamino)propyl]-5-sulfamoylbenzamide;hydrochloride
CID 120828882
N-[1-(4-ethylphenyl)ethyl]-2-methoxy-5-sulfamoylbenzamide
CID 51164410
N-ethyl-2-methoxy-5-sulfamoylbenzamide
CID 6473438
N-(1-cyclobutylethyl)-2-methoxy-5-sulfamoylbenzamide
CID 115769101
2-methoxy-N-(2-methylbutyl)-5-sulfamoylbenzamide
CID 65388845
2-methyl-N-(6-methylheptan-2-yl)-5-sulfamoylbenzamide
CID 46515920
2-methoxy-N-[(1R)-1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-5-sulfamoylbenzamide
CID 125170561
[2-oxo-2-(propan-2-ylamino)ethyl] 2-methoxy-5-sulfamoylbenzoate
CID 7467931
2-methylpentyl 2-methoxy-5-sulfamoylbenzoate
CID 103286167
N-(2-cyclopropylpropyl)-2-methoxy-5-sulfamoylbenzamide
CID 115591271

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide?
The IUPAC name of 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide (CID 43019463) is 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide.
What is the SMILES notation for 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide?
The canonical SMILES for 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide is COc1ccc(S(N)(=O)=O)cc1C(=O)NC(C)CCC(C)C.
What is the InChIKey of 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide?
The InChIKey is GOAAYTTVSATFCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4S/c1-10(2)5-6-11(3)17-15(18)13-9-12(22(16,19)20)7-8-14(13)21-4/h7-11H,5-6H2,1-4H3,(H,17,18)(H2,16,19,20).
What are the key properties of 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide?
2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide has a molecular weight of 328.43 g/mol, XLogP of 1.90, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(5-methylhexan-2-yl)-5-sulfamoylbenzamide is sourced from PubChem (CID 43019463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).