N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide

C10H17N3O2S2 — CID 103415221

IUPACN-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide
SMILESCCCN(C1CNC1)S(=O)(=O)c1cnc(C)s1
InChIInChI=1S/C10H17N3O2S2/c1-3-4-13(9-5-11-6-9)17(14,15)10-7-12-8(2)16-10/h7,9,11H,3-6H2,1-2H3
InChIKeyDXQCIXIUVDOGTP-UHFFFAOYSA-N
MW275.40 g/mol
LogP0.82
Rot. Bonds5

About N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide

N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide (PubChem CID 103415221) has the molecular formula C10H17N3O2S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide
PubChem CID103415221
Molecular FormulaC10H17N3O2S2
Molecular Weight275.40 g/mol
Exact Mass275.08
IUPAC NameN-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide
SMILESCCCN(C1CNC1)S(=O)(=O)c1cnc(C)s1
InChIInChI=1S/C10H17N3O2S2/c1-3-4-13(9-5-11-6-9)17(14,15)10-7-12-8(2)16-10/h7,9,11H,3-6H2,1-2H3
InChIKeyDXQCIXIUVDOGTP-UHFFFAOYSA-N
XLogP0.82
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-piperidin-4-yl-N-propyl-1,3-thiazole-5-sulfonamide
CID 103951467
N-(2-bromoethyl)-N-cyclopentyl-2-methyl-1,3-thiazole-5-sulfonamide
CID 103415990
N-cyclohexyl-N-(2-hydroxyethyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414836
N-(azetidin-3-yl)-1,2-dimethyl-N-propylimidazole-4-sulfonamide
CID 66215276
N-(azetidin-3-yl)-4-iodo-N-propylbenzenesulfonamide
CID 66216683
N-(azetidin-3-yl)-3,5-dichloro-N-propylbenzenesulfonamide
CID 66215475
2-methyl-N-propyl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide;hydrochloride
CID 119533138
N-(azetidin-3-yl)-2,4-dimethyl-N-propylbenzenesulfonamide
CID 66214666
N-(4-aminophenyl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide
CID 103413967
5-methyl-N-piperidin-4-yl-N-propylthiophene-2-sulfonamide
CID 54923399
N-propyl-N-[(3S)-pyrrolidin-3-yl]thiophene-2-sulfonamide
CID 95395150
5-chloro-4-methyl-N-piperidin-4-yl-N-propylthiophene-2-sulfonamide
CID 103100371

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide (CID 103415221) is N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide is CCCN(C1CNC1)S(=O)(=O)c1cnc(C)s1.
What is the InChIKey of N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide?
The InChIKey is DXQCIXIUVDOGTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S2/c1-3-4-13(9-5-11-6-9)17(14,15)10-7-12-8(2)16-10/h7,9,11H,3-6H2,1-2H3.
What are the key properties of N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide?
N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide has a molecular weight of 275.40 g/mol, XLogP of 0.82, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-2-methyl-N-propyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 103415221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).