5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole

C15H19N3O3S2 — CID 56707401

IUPAC5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole
SMILESO=S(=O)(c1ccc(-c2ccno2)s1)N1CCC2(CCNCC2)C1
InChIInChI=1S/C15H19N3O3S2/c19-23(20,14-2-1-13(22-14)12-3-7-17-21-12)18-10-6-15(11-18)4-8-16-9-5-15/h1-3,7,16H,4-6,8-11H2
InChIKeyLHDWOUHGVNGBBJ-UHFFFAOYSA-N
MW353.47 g/mol
LogP2.17
Rot. Bonds3

About 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole

5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole (PubChem CID 56707401) has the molecular formula C15H19N3O3S2 and a molecular weight of 353.47 g/mol. Its IUPAC name is 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole.

Molecular Properties

Compound Name5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole
PubChem CID56707401
Molecular FormulaC15H19N3O3S2
Molecular Weight353.47 g/mol
Exact Mass353.09
IUPAC Name5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole
SMILESO=S(=O)(c1ccc(-c2ccno2)s1)N1CCC2(CCNCC2)C1
InChIInChI=1S/C15H19N3O3S2/c19-23(20,14-2-1-13(22-14)12-3-7-17-21-12)18-10-6-15(11-18)4-8-16-9-5-15/h1-3,7,16H,4-6,8-11H2
InChIKeyLHDWOUHGVNGBBJ-UHFFFAOYSA-N
XLogP2.17
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-{[5-(5-Isoxazolyl)-2-thienyl]sulfonyl}piperidine
CID 1471911
N-[[1-(3-methylbutyl)piperidin-4-yl]methyl]-5-[3-(trifluoromethyl)-1,2-oxazol-5-yl]thiophene-2-sulfonamide
CID 45106774
Ethyl 1-{[5-(1,2-oxazol-5-yl)thiophen-2-yl]sulfonyl}piperidine-4-carboxylate
CID 18525662
5-(1,2-oxazol-5-yl)-N-(4-piperidin-1-ylphenyl)thiophene-2-sulfonamide
CID 18525686
5-(3-methyl-1,2-oxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)thiophene-2-sulfonamide
CID 20936306
5-[5-(Pyrrolidin-1-ylsulfonyl)thiophen-2-yl]-1,2-oxazole
CID 21039664
N-[(2,4-difluorophenyl)methyl]-5-(1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 21039667
2,5-dimethyl-N-(2-methylbutan-2-yl)-4-(1,2-oxazol-5-yl)thiophene-3-sulfonamide
CID 53057130
2,5-dimethyl-N-(4-methylcyclohexyl)-4-(1,2-oxazol-5-yl)thiophene-3-sulfonamide
CID 53057131
1-{[2-Methyl-5-(1,2-oxazol-5-YL)thiophen-3-YL]sulfonyl}piperidine
CID 53079539
5-(1,2-Oxazol-5-YL)-N-(propan-2-YL)thiophene-2-sulfonamide
CID 53111967
5-(Isoxazol-5-YL)thiophene-2-sulphonamide
CID 18526374

Frequently Asked Questions

What is the IUPAC name of 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole?
The IUPAC name of 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole (CID 56707401) is 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole.
What is the SMILES notation for 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole?
The canonical SMILES for 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole is O=S(=O)(c1ccc(-c2ccno2)s1)N1CCC2(CCNCC2)C1.
What is the InChIKey of 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole?
The InChIKey is LHDWOUHGVNGBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3S2/c19-23(20,14-2-1-13(22-14)12-3-7-17-21-12)18-10-6-15(11-18)4-8-16-9-5-15/h1-3,7,16H,4-6,8-11H2.
What are the key properties of 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole?
5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole has a molecular weight of 353.47 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(2,8-diazaspiro[4.5]decan-2-ylsulfonyl)thiophen-2-yl]-1,2-oxazole is sourced from PubChem (CID 56707401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).