N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide

C13H15N3O3S — CID 110723188

IUPACN-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)N(c1ccccn1)C1CC1
InChIInChI=1S/C13H15N3O3S/c1-9-13(10(2)19-15-9)20(17,18)16(11-6-7-11)12-5-3-4-8-14-12/h3-5,8,11H,6-7H2,1-2H3
InChIKeyRGDMCZMXAPPZCE-UHFFFAOYSA-N
MW293.35 g/mol
LogP2.04
Rot. Bonds4

About N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide

N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide (PubChem CID 110723188) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide
PubChem CID110723188
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC NameN-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)N(c1ccccn1)C1CC1
InChIInChI=1S/C13H15N3O3S/c1-9-13(10(2)19-15-9)20(17,18)16(11-6-7-11)12-5-3-4-8-14-12/h3-5,8,11H,6-7H2,1-2H3
InChIKeyRGDMCZMXAPPZCE-UHFFFAOYSA-N
XLogP2.04
TPSA76.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 2814174
N-cyclopropyl-4-methoxy-2-methyl-N-pyridin-2-ylbenzenesulfonamide
CID 110723157
N-cyclopropyl-1-(2-methylphenyl)-N-pyridin-2-ylmethanesulfonamide
CID 110723172
5-chloro-N-cyclopropyl-N-pyridin-2-ylthiophene-2-sulfonamide
CID 110723168
N-(3,4-dihydro-2H-chromen-4-yl)-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 110751240
(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[methyl(pyridin-2-yl)amino]piperidin-1-yl]methanone
CID 163347120
N,3,5-trimethyl-N-[(1S,3R)-3-methylcyclohexyl]-1,2-oxazole-4-sulfonamide
CID 34136811
N-cyclopropyl-3-nitro-N-pyridin-2-ylbenzenesulfonamide
CID 110723195
N-[1-(5-fluoro-6-phenylpyrimidin-4-yl)azetidin-3-yl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 139023653
N-cyclopropyl-N-methylpyridin-2-amine;hydrochloride
CID 69197423
N-(1-cyclopropylethyl)-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 134018149
N-[1-(3-cyanopyrazin-2-yl)azetidin-3-yl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
CID 139023355

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide?
The IUPAC name of N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide (CID 110723188) is N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide?
The canonical SMILES for N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide is Cc1noc(C)c1S(=O)(=O)N(c1ccccn1)C1CC1.
What is the InChIKey of N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide?
The InChIKey is RGDMCZMXAPPZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-9-13(10(2)19-15-9)20(17,18)16(11-6-7-11)12-5-3-4-8-14-12/h3-5,8,11H,6-7H2,1-2H3.
What are the key properties of N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide?
N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide has a molecular weight of 293.35 g/mol, XLogP of 2.04, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3,5-dimethyl-N-pyridin-2-yl-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 110723188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).