N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide

C9H15N3O3S — CID 47180721

IUPACN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide
SMILESCc1nc(C2(NS(C)(=O)=O)CCCC2)no1
InChIInChI=1S/C9H15N3O3S/c1-7-10-8(11-15-7)9(5-3-4-6-9)12-16(2,13)14/h12H,3-6H2,1-2H3
InChIKeyAGSBHSZZCNQUQT-UHFFFAOYSA-N
MW245.30 g/mol
LogP0.70
Rot. Bonds3

About N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide

N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide (PubChem CID 47180721) has the molecular formula C9H15N3O3S and a molecular weight of 245.30 g/mol. Its IUPAC name is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide
PubChem CID47180721
Molecular FormulaC9H15N3O3S
Molecular Weight245.30 g/mol
Exact Mass245.08
IUPAC NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide
SMILESCc1nc(C2(NS(C)(=O)=O)CCCC2)no1
InChIInChI=1S/C9H15N3O3S/c1-7-10-8(11-15-7)9(5-3-4-6-9)12-16(2,13)14/h12H,3-6H2,1-2H3
InChIKeyAGSBHSZZCNQUQT-UHFFFAOYSA-N
XLogP0.70
TPSA85.09 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide?
The IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide (CID 47180721) is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide.
What is the SMILES notation for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide?
The canonical SMILES for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide is Cc1nc(C2(NS(C)(=O)=O)CCCC2)no1.
What is the InChIKey of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide?
The InChIKey is AGSBHSZZCNQUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3S/c1-7-10-8(11-15-7)9(5-3-4-6-9)12-16(2,13)14/h12H,3-6H2,1-2H3.
What are the key properties of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide?
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide has a molecular weight of 245.30 g/mol, XLogP of 0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]methanesulfonamide is sourced from PubChem (CID 47180721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).