tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate

C15H25N3O6S — CID 155225154

IUPACtert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate
SMILESCc1noc(N(C2CCOCC2)S(=O)(=O)NC(=O)OC(C)(C)C)c1C
InChIInChI=1S/C15H25N3O6S/c1-10-11(2)16-24-13(10)18(12-6-8-22-9-7-12)25(20,21)17-14(19)23-15(3,4)5/h12H,6-9H2,1-5H3,(H,17,19)
InChIKeyZGPSWNFBVATAME-UHFFFAOYSA-N
MW375.45 g/mol
LogP2.05
Rot. Bonds4

About tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate

tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate (PubChem CID 155225154) has the molecular formula C15H25N3O6S and a molecular weight of 375.45 g/mol. Its IUPAC name is tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate
PubChem CID155225154
Molecular FormulaC15H25N3O6S
Molecular Weight375.45 g/mol
Exact Mass375.15
IUPAC Nametert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate
SMILESCc1noc(N(C2CCOCC2)S(=O)(=O)NC(=O)OC(C)(C)C)c1C
InChIInChI=1S/C15H25N3O6S/c1-10-11(2)16-24-13(10)18(12-6-8-22-9-7-12)25(20,21)17-14(19)23-15(3,4)5/h12H,6-9H2,1-5H3,(H,17,19)
InChIKeyZGPSWNFBVATAME-UHFFFAOYSA-N
XLogP2.05
TPSA110.97 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate with MolForge

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Related Compounds

tert-butyl N-[(5-methyl-1H-pyrazol-4-yl)-(oxan-4-yl)sulfamoyl]carbamate
CID 155225067
tert-butyl N-(oxan-4-ylmethylsulfamoyl)carbamate
CID 155097474
tert-butyl N-(4-bromo-3-methyl-1,2-oxazol-5-yl)-N-cyclopropylcarbamate
CID 67813716
[(5-methyl-1H-pyrazol-4-yl)-(oxan-4-yl)sulfamoyl]carbamic acid
CID 155225412
tert-butyl N-(5-amino-3-methyl-1,2-oxazol-4-yl)carbamate
CID 117274287
tert-butyl N-[(1-methylpyrazol-4-yl)-[[(2R)-oxolan-2-yl]methyl]sulfamoyl]carbamate
CID 162749581
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(oxan-4-yl)-N-propan-2-ylpropanamide
CID 95981405
sodium 1,2,3,5,6,7-hexahydro-s-indacen-4-ylcarbamoyl-[[3-(methoxymethyl)-4-methyl-1,2-oxazol-5-yl]-(oxan-4-yl)sulfamoyl]azanide
CID 159586805
tert-butyl N-[(3S,4R)-4-formyloxan-3-yl]carbamate
CID 59094980
N'-[(3-ethyl-4-methyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]-N-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)carbamimidate
CID 155760729
tert-butyl N-[[(3R,5S)-5-fluoro-1-methylpiperidin-3-yl]-(1-methylpyrazol-4-yl)sulfamoyl]carbamate
CID 155389034
tert-butyl N-[2-(oxan-4-ylmethylamino)cyclopropyl]carbamate
CID 107238309

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate?
The IUPAC name of tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate (CID 155225154) is tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate.
What is the SMILES notation for tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate?
The canonical SMILES for tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate is Cc1noc(N(C2CCOCC2)S(=O)(=O)NC(=O)OC(C)(C)C)c1C.
What is the InChIKey of tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate?
The InChIKey is ZGPSWNFBVATAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O6S/c1-10-11(2)16-24-13(10)18(12-6-8-22-9-7-12)25(20,21)17-14(19)23-15(3,4)5/h12H,6-9H2,1-5H3,(H,17,19).
What are the key properties of tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate?
tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate has a molecular weight of 375.45 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[(3,4-dimethyl-1,2-oxazol-5-yl)-(oxan-4-yl)sulfamoyl]carbamate is sourced from PubChem (CID 155225154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).