N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide

C9H13N3O4S2 — CID 42560685

IUPACN-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1ncc(S(=O)(=O)N2CCOCC2)s1
InChIInChI=1S/C9H13N3O4S2/c1-7(13)11-9-10-6-8(17-9)18(14,15)12-2-4-16-5-3-12/h6H,2-5H2,1H3,(H,10,11,13)
InChIKeyBSGVACGFGCXGNA-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.12
Rot. Bonds3

About N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide

N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide (PubChem CID 42560685) has the molecular formula C9H13N3O4S2 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide
PubChem CID42560685
Molecular FormulaC9H13N3O4S2
Molecular Weight291.35 g/mol
Exact Mass291.03
IUPAC NameN-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide
SMILESCC(=O)Nc1ncc(S(=O)(=O)N2CCOCC2)s1
InChIInChI=1S/C9H13N3O4S2/c1-7(13)11-9-10-6-8(17-9)18(14,15)12-2-4-16-5-3-12/h6H,2-5H2,1H3,(H,10,11,13)
InChIKeyBSGVACGFGCXGNA-UHFFFAOYSA-N
XLogP0.12
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide (CID 42560685) is N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide is CC(=O)Nc1ncc(S(=O)(=O)N2CCOCC2)s1.
What is the InChIKey of N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is BSGVACGFGCXGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O4S2/c1-7(13)11-9-10-6-8(17-9)18(14,15)12-2-4-16-5-3-12/h6H,2-5H2,1H3,(H,10,11,13).
What are the key properties of N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide?
N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 0.12, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-morpholin-4-ylsulfonyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 42560685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).