N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide

C11H17N3O4S — CID 47184528

IUPACN-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide
SMILESCc1cc(C(=O)N2CCCC(NS(C)(=O)=O)C2)on1
InChIInChI=1S/C11H17N3O4S/c1-8-6-10(18-12-8)11(15)14-5-3-4-9(7-14)13-19(2,16)17/h6,9,13H,3-5,7H2,1-2H3
InChIKeyLMOKHLGUFVCZJL-UHFFFAOYSA-N
MW287.34 g/mol
LogP0.14
Rot. Bonds3

About N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide

N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide (PubChem CID 47184528) has the molecular formula C11H17N3O4S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide
PubChem CID47184528
Molecular FormulaC11H17N3O4S
Molecular Weight287.34 g/mol
Exact Mass287.09
IUPAC NameN-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide
SMILESCc1cc(C(=O)N2CCCC(NS(C)(=O)=O)C2)on1
InChIInChI=1S/C11H17N3O4S/c1-8-6-10(18-12-8)11(15)14-5-3-4-9(7-14)13-19(2,16)17/h6,9,13H,3-5,7H2,1-2H3
InChIKeyLMOKHLGUFVCZJL-UHFFFAOYSA-N
XLogP0.14
TPSA92.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3S)-1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]benzenesulfonamide
CID 95297567
(3-chloropiperidin-1-yl)-(3-methyl-1,2-oxazol-5-yl)methanone
CID 63392780
N-[1-(5-methylfuran-2-carbonyl)piperidin-3-yl]methanesulfonamide
CID 47184451
N-[1-(4-chloro-6-methylpyridine-3-carbonyl)piperidin-3-yl]methanesulfonamide
CID 81231053
N-[(5S,9R)-2-(3-methyl-1,2-oxazole-5-carbonyl)-6-oxa-2-azaspiro[4.5]decan-9-yl]methanesulfonamide
CID 124912808
N-[1-(3,5-dibromobenzoyl)piperidin-3-yl]methanesulfonamide
CID 103907786
2-methyl-2-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]propanoic acid
CID 83197337
N-[(3R)-1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]-1-propan-2-ylpyrazole-3-carboxamide
CID 125420753
1-cyclohexyl-3-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-4-yl]urea
CID 51092058
(3-methyl-1,2-oxazol-5-yl)-(4-methylsulfonyl-1,4-diazepan-1-yl)methanone
CID 43060282
N-[1-(2H-triazole-4-carbonyl)piperidin-3-yl]methanesulfonamide
CID 113226212
3-[3-(methanesulfonamido)piperidine-1-carbonyl]benzoic acid
CID 126773299

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide?
The IUPAC name of N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide (CID 47184528) is N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide.
What is the SMILES notation for N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide?
The canonical SMILES for N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide is Cc1cc(C(=O)N2CCCC(NS(C)(=O)=O)C2)on1.
What is the InChIKey of N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide?
The InChIKey is LMOKHLGUFVCZJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4S/c1-8-6-10(18-12-8)11(15)14-5-3-4-9(7-14)13-19(2,16)17/h6,9,13H,3-5,7H2,1-2H3.
What are the key properties of N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide?
N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide has a molecular weight of 287.34 g/mol, XLogP of 0.14, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methyl-1,2-oxazole-5-carbonyl)piperidin-3-yl]methanesulfonamide is sourced from PubChem (CID 47184528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).