2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide

C9H13N3O4S2 — CID 60668235

IUPAC2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide
SMILESCN(CC(=O)NCC(N)=O)S(=O)(=O)c1cccs1
InChIInChI=1S/C9H13N3O4S2/c1-12(6-8(14)11-5-7(10)13)18(15,16)9-3-2-4-17-9/h2-4H,5-6H2,1H3,(H2,10,13)(H,11,14)
InChIKeyYDGCKDDYRSSGDX-UHFFFAOYSA-N
MW291.35 g/mol
LogP-1.03
Rot. Bonds6

About 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide

2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide (PubChem CID 60668235) has the molecular formula C9H13N3O4S2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide.

Molecular Properties

Compound Name2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide
PubChem CID60668235
Molecular FormulaC9H13N3O4S2
Molecular Weight291.35 g/mol
Exact Mass291.03
IUPAC Name2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide
SMILESCN(CC(=O)NCC(N)=O)S(=O)(=O)c1cccs1
InChIInChI=1S/C9H13N3O4S2/c1-12(6-8(14)11-5-7(10)13)18(15,16)9-3-2-4-17-9/h2-4H,5-6H2,1H3,(H2,10,13)(H,11,14)
InChIKeyYDGCKDDYRSSGDX-UHFFFAOYSA-N
XLogP-1.03
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 65109706
N-(2-hydroxypropyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 43418420
N-(2-ethylbutyl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 115612731
2-[methyl(thiophen-2-ylsulfonyl)amino]-N-pentylacetamide
CID 18108266
N-[(1-hydroxycyclobutyl)methyl]-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 115643486
N-tert-butyl-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 4190570
5-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]pentanoic acid
CID 62032128
methyl 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate
CID 3312195
2-[methyl(thiophen-2-ylsulfonyl)amino]-N-[(5-sulfamoylthiophen-2-yl)methyl]acetamide
CID 18230583
N-[(2-fluorophenyl)methyl]-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 9142227
N'-hydroxy-2-[methyl(thiophen-2-ylsulfonyl)amino]ethanimidamide
CID 76928975
N-[[1-(dimethylamino)cycloheptyl]methyl]-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 18165137

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide?
The IUPAC name of 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide (CID 60668235) is 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide.
What is the SMILES notation for 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide?
The canonical SMILES for 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide is CN(CC(=O)NCC(N)=O)S(=O)(=O)c1cccs1.
What is the InChIKey of 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide?
The InChIKey is YDGCKDDYRSSGDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O4S2/c1-12(6-8(14)11-5-7(10)13)18(15,16)9-3-2-4-17-9/h2-4H,5-6H2,1H3,(H2,10,13)(H,11,14).
What are the key properties of 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide?
2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide has a molecular weight of 291.35 g/mol, XLogP of -1.03, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]acetamide is sourced from PubChem (CID 60668235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).