5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide

C12H18N2O5S — CID 65113342

IUPAC5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide
SMILESCOc1ccc(S(=O)(=O)NCC(C)(C)O)cc1C(N)=O
InChIInChI=1S/C12H18N2O5S/c1-12(2,16)7-14-20(17,18)8-4-5-10(19-3)9(6-8)11(13)15/h4-6,14,16H,7H2,1-3H3,(H2,13,15)
InChIKeyBBRYUVAVWOQQRP-UHFFFAOYSA-N
MW302.35 g/mol
LogP-0.16
Rot. Bonds6

About 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide

5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide (PubChem CID 65113342) has the molecular formula C12H18N2O5S and a molecular weight of 302.35 g/mol. Its IUPAC name is 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide.

Molecular Properties

Compound Name5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide
PubChem CID65113342
Molecular FormulaC12H18N2O5S
Molecular Weight302.35 g/mol
Exact Mass302.09
IUPAC Name5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide
SMILESCOc1ccc(S(=O)(=O)NCC(C)(C)O)cc1C(N)=O
InChIInChI=1S/C12H18N2O5S/c1-12(2,16)7-14-20(17,18)8-4-5-10(19-3)9(6-8)11(13)15/h4-6,14,16H,7H2,1-3H3,(H2,13,15)
InChIKeyBBRYUVAVWOQQRP-UHFFFAOYSA-N
XLogP-0.16
TPSA118.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-(tert-butylsulfamoyl)-2-methoxybenzamide
CID 42562024
5-[(1-aminocyclohexyl)methylsulfamoyl]-2-methoxybenzamide
CID 119958906
methyl 5-[(2-amino-2-ethylbutyl)sulfamoyl]-2-methoxybenzoate
CID 119989908
5-[(3-hydroxycyclobutyl)methylsulfamoyl]-2-methoxybenzamide
CID 66006744
5-(1,3-dihydroxypropan-2-ylsulfamoyl)-2-methoxybenzamide
CID 65314128
5-(furan-2-ylmethylsulfamoyl)-2-methoxybenzamide
CID 34027934
5-[(2-chlorophenyl)methylsulfamoyl]-2-methoxybenzamide
CID 34029898
2-methoxy-5-(3-pyrrolidin-1-ylpropylsulfamoyl)benzamide
CID 53499321
5-[(1-amino-2,4-dimethylpentan-2-yl)sulfamoyl]-2-methoxybenzamide
CID 119984979
2-methoxy-5-sulfamoylbenzamide;hydrochloride
CID 22748858
N-(2-hydroxy-2-methylpropyl)-4-methoxybenzenesulfonamide
CID 65112797
5-[2,2-bis(furan-2-yl)ethylsulfamoyl]-2-methoxybenzamide
CID 131703692

Frequently Asked Questions

What is the IUPAC name of 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide?
The IUPAC name of 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide (CID 65113342) is 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide.
What is the SMILES notation for 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide?
The canonical SMILES for 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide is COc1ccc(S(=O)(=O)NCC(C)(C)O)cc1C(N)=O.
What is the InChIKey of 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide?
The InChIKey is BBRYUVAVWOQQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O5S/c1-12(2,16)7-14-20(17,18)8-4-5-10(19-3)9(6-8)11(13)15/h4-6,14,16H,7H2,1-3H3,(H2,13,15).
What are the key properties of 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide?
5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide has a molecular weight of 302.35 g/mol, XLogP of -0.16, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide is sourced from PubChem (CID 65113342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).