2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide

C7H10ClN3O3S2 — CID 43567062

IUPAC2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide
SMILESCCNC(=O)CNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C7H10ClN3O3S2/c1-2-9-5(12)3-11-16(13,14)6-4-10-7(8)15-6/h4,11H,2-3H2,1H3,(H,9,12)
InChIKeyOAGCXXQTIKRWLE-UHFFFAOYSA-N
MW283.76 g/mol
LogP0.21
Rot. Bonds5

About 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide

2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide (PubChem CID 43567062) has the molecular formula C7H10ClN3O3S2 and a molecular weight of 283.76 g/mol. Its IUPAC name is 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide.

Molecular Properties

Compound Name2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide
PubChem CID43567062
Molecular FormulaC7H10ClN3O3S2
Molecular Weight283.76 g/mol
Exact Mass282.99
IUPAC Name2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide
SMILESCCNC(=O)CNS(=O)(=O)c1cnc(Cl)s1
InChIInChI=1S/C7H10ClN3O3S2/c1-2-9-5(12)3-11-16(13,14)6-4-10-7(8)15-6/h4,11H,2-3H2,1H3,(H,9,12)
InChIKeyOAGCXXQTIKRWLE-UHFFFAOYSA-N
XLogP0.21
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.76
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide?
The IUPAC name of 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide (CID 43567062) is 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide.
What is the SMILES notation for 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide?
The canonical SMILES for 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide is CCNC(=O)CNS(=O)(=O)c1cnc(Cl)s1.
What is the InChIKey of 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide?
The InChIKey is OAGCXXQTIKRWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3O3S2/c1-2-9-5(12)3-11-16(13,14)6-4-10-7(8)15-6/h4,11H,2-3H2,1H3,(H,9,12).
What are the key properties of 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide?
2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide has a molecular weight of 283.76 g/mol, XLogP of 0.21, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-ethylacetamide is sourced from PubChem (CID 43567062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).