3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide

C7H10ClN3O4S2 — CID 106173704

IUPAC3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide
SMILESCc1nc(Cl)sc1S(=O)(=O)NCC(O)C(N)=O
InChIInChI=1S/C7H10ClN3O4S2/c1-3-6(16-7(8)11-3)17(14,15)10-2-4(12)5(9)13/h4,10,12H,2H2,1H3,(H2,9,13)
InChIKeyBMHKYQGMJYPPCQ-UHFFFAOYSA-N
MW299.76 g/mol
LogP-0.77
Rot. Bonds5

About 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide

3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide (PubChem CID 106173704) has the molecular formula C7H10ClN3O4S2 and a molecular weight of 299.76 g/mol. Its IUPAC name is 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide
PubChem CID106173704
Molecular FormulaC7H10ClN3O4S2
Molecular Weight299.76 g/mol
Exact Mass298.98
IUPAC Name3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide
SMILESCc1nc(Cl)sc1S(=O)(=O)NCC(O)C(N)=O
InChIInChI=1S/C7H10ClN3O4S2/c1-3-6(16-7(8)11-3)17(14,15)10-2-4(12)5(9)13/h4,10,12H,2H2,1H3,(H2,9,13)
InChIKeyBMHKYQGMJYPPCQ-UHFFFAOYSA-N
XLogP-0.77
TPSA122.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.76
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]ethyl carbamate
CID 83210333
2-chloro-4-methyl-N-(2-phenylpropyl)-1,3-thiazole-5-sulfonamide
CID 42956033
4-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]butanoic acid
CID 61249811
2-chloro-N-(2,2-difluoro-3-hydroxypropyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 104858839
methyl 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]propanoate
CID 61053412
3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-N,N-dimethylpropanamide
CID 61041117
2-chloro-4-methyl-N-(2-methylsulfanylethyl)-1,3-thiazole-5-sulfonamide
CID 61053561
2-chloro-N-(5-hydroxy-2,2-dimethylpentyl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 103896643
2-chloro-4-methyl-N-(2-methyl-2-methylsulfonylpropyl)-1,3-thiazole-5-sulfonamide
CID 79550454
2-chloro-N-(2-methoxyethoxy)-4-methyl-1,3-thiazole-5-sulfonamide
CID 107856739
2-chloro-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-methyl-1,3-thiazole-5-sulfonamide
CID 114387374
2-chloro-N-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazole-5-sulfonamide
CID 43415395

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide?
The IUPAC name of 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide (CID 106173704) is 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide?
The canonical SMILES for 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide is Cc1nc(Cl)sc1S(=O)(=O)NCC(O)C(N)=O.
What is the InChIKey of 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide?
The InChIKey is BMHKYQGMJYPPCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3O4S2/c1-3-6(16-7(8)11-3)17(14,15)10-2-4(12)5(9)13/h4,10,12H,2H2,1H3,(H2,9,13).
What are the key properties of 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide?
3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide has a molecular weight of 299.76 g/mol, XLogP of -0.77, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chloro-4-methyl-1,3-thiazol-5-yl)sulfonylamino]-2-hydroxypropanamide is sourced from PubChem (CID 106173704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).