N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide

C9H13N3O4S2 — CID 63945642

IUPACN-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESCc1nc(NC(=O)C2CCOC2)sc1S(N)(=O)=O
InChIInChI=1S/C9H13N3O4S2/c1-5-8(18(10,14)15)17-9(11-5)12-7(13)6-2-3-16-4-6/h6H,2-4H2,1H3,(H2,10,14,15)(H,11,12,13)
InChIKeyVOVLFDVOQCRUOU-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.07
Rot. Bonds3

About N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide

N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide (PubChem CID 63945642) has the molecular formula C9H13N3O4S2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
PubChem CID63945642
Molecular FormulaC9H13N3O4S2
Molecular Weight291.35 g/mol
Exact Mass291.03
IUPAC NameN-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESCc1nc(NC(=O)C2CCOC2)sc1S(N)(=O)=O
InChIInChI=1S/C9H13N3O4S2/c1-5-8(18(10,14)15)17-9(11-5)12-7(13)6-2-3-16-4-6/h6H,2-4H2,1H3,(H2,10,14,15)(H,11,12,13)
InChIKeyVOVLFDVOQCRUOU-UHFFFAOYSA-N
XLogP0.07
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxane-4-carboxamide
CID 63945641
N-[4-methyl-5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]oxolane-3-carboxamide
CID 86849733
N-(2,6-dimethyl-4-sulfamoylphenyl)oxolane-3-carboxamide
CID 61277687
2-cycloheptyl-N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)acetamide
CID 114458264
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)oxolane-3-carboxamide
CID 56675559
2-(cyclopropylsulfonylamino)-4-methyl-1,3-thiazole-5-sulfonamide
CID 64553272
(3S)-N-(4-cyclopropyl-1,3-thiazol-2-yl)oxolane-3-carboxamide
CID 94211482
N-(3,5-dimethylphenyl)oxolane-3-carboxamide
CID 47443287
N-(2-sulfamoylethyl)oxolane-3-carboxamide
CID 61277309
N-[1-(4-sulfamoylphenyl)ethyl]oxolane-3-carboxamide
CID 47364042
(3R)-N-(5-methyl-1,2-oxazol-3-yl)oxolane-3-carboxamide
CID 27242204
N-[4-(2-methylphenyl)-1,3-thiazol-2-yl]oxolane-3-carboxamide
CID 75921279

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
The IUPAC name of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide (CID 63945642) is N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
The canonical SMILES for N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide is Cc1nc(NC(=O)C2CCOC2)sc1S(N)(=O)=O.
What is the InChIKey of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
The InChIKey is VOVLFDVOQCRUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O4S2/c1-5-8(18(10,14)15)17-9(11-5)12-7(13)6-2-3-16-4-6/h6H,2-4H2,1H3,(H2,10,14,15)(H,11,12,13).
What are the key properties of N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide?
N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.07, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-5-sulfamoyl-1,3-thiazol-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 63945642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).