2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide

C10H17N3O2S2 — CID 113475570

IUPAC2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(N)sc1S(=O)(=O)NCC(C)C1CC1
InChIInChI=1S/C10H17N3O2S2/c1-6(8-3-4-8)5-12-17(14,15)9-7(2)13-10(11)16-9/h6,8,12H,3-5H2,1-2H3,(H2,11,13)
InChIKeyISFSQMCNBYPATC-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.36
Rot. Bonds5

About 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide

2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 113475570) has the molecular formula C10H17N3O2S2 and a molecular weight of 275.40 g/mol. Its IUPAC name is 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide
PubChem CID113475570
Molecular FormulaC10H17N3O2S2
Molecular Weight275.40 g/mol
Exact Mass275.08
IUPAC Name2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(N)sc1S(=O)(=O)NCC(C)C1CC1
InChIInChI=1S/C10H17N3O2S2/c1-6(8-3-4-8)5-12-17(14,15)9-7(2)13-10(11)16-9/h6,8,12H,3-5H2,1-2H3,(H2,11,13)
InChIKeyISFSQMCNBYPATC-UHFFFAOYSA-N
XLogP1.36
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide (CID 113475570) is 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide is Cc1nc(N)sc1S(=O)(=O)NCC(C)C1CC1.
What is the InChIKey of 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is ISFSQMCNBYPATC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2S2/c1-6(8-3-4-8)5-12-17(14,15)9-7(2)13-10(11)16-9/h6,8,12H,3-5H2,1-2H3,(H2,11,13).
What are the key properties of 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide?
2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 275.40 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-cyclopropylpropyl)-4-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 113475570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).