N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide

C11H19N3O3S — CID 54973736

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide
SMILESCc1cc(NS(=O)(=O)CCC2CCCCN2)no1
InChIInChI=1S/C11H19N3O3S/c1-9-8-11(13-17-9)14-18(15,16)7-5-10-4-2-3-6-12-10/h8,10,12H,2-7H2,1H3,(H,13,14)
InChIKeyAJHKUZUZIHGFDS-UHFFFAOYSA-N
MW273.36 g/mol
LogP1.26
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide

N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide (PubChem CID 54973736) has the molecular formula C11H19N3O3S and a molecular weight of 273.36 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide
PubChem CID54973736
Molecular FormulaC11H19N3O3S
Molecular Weight273.36 g/mol
Exact Mass273.11
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide
SMILESCc1cc(NS(=O)(=O)CCC2CCCCN2)no1
InChIInChI=1S/C11H19N3O3S/c1-9-8-11(13-17-9)14-18(15,16)7-5-10-4-2-3-6-12-10/h8,10,12H,2-7H2,1H3,(H,13,14)
InChIKeyAJHKUZUZIHGFDS-UHFFFAOYSA-N
XLogP1.26
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.36
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methyl-1,2-oxazol-3-yl)-3-piperidin-2-ylpropanamide
CID 62212570
N-(2,5-difluoro-4-methylphenyl)-2-piperidin-2-ylethanesulfonamide
CID 103586278
N-(3-methyl-1,2-oxazol-5-yl)-1-piperidin-2-ylmethanesulfonamide
CID 54973614
N-(5-methyl-1,2-oxazol-3-yl)butane-1-sulfonamide
CID 6465435
N-methyl-1-(5-methyl-1,2-oxazol-3-yl)-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106607330
N-(5-methyl-1,2-oxazol-3-yl)piperidine-2-carboxamide
CID 18071476
N-(4-bromo-2,6-difluorophenyl)-2-piperidin-2-ylethanesulfonamide
CID 65499786
N-(2-chloro-6-methylphenyl)-2-piperidin-2-ylethanesulfonamide
CID 66256676
N-(3-bromo-2-methylphenyl)-2-piperidin-2-ylethanesulfonamide
CID 107626693
N-(2-methylsulfanylphenyl)-2-piperidin-2-ylethanesulfonamide
CID 107642155
N-(3-fluorophenyl)-2-piperidin-2-ylethanesulfonamide
CID 60865299
N-(3-methoxyphenyl)-2-piperidin-2-ylethanesulfonamide
CID 60864201

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide (CID 54973736) is N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide is Cc1cc(NS(=O)(=O)CCC2CCCCN2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide?
The InChIKey is AJHKUZUZIHGFDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3S/c1-9-8-11(13-17-9)14-18(15,16)7-5-10-4-2-3-6-12-10/h8,10,12H,2-7H2,1H3,(H,13,14).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide has a molecular weight of 273.36 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-piperidin-2-ylethanesulfonamide is sourced from PubChem (CID 54973736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).