2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide

C10H21N3O3S — CID 120654491

IUPAC2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide
SMILESCCN[C@H](C)CNC(=O)CN1CCCS1(=O)=O
InChIInChI=1S/C10H21N3O3S/c1-3-11-9(2)7-12-10(14)8-13-5-4-6-17(13,15)16/h9,11H,3-8H2,1-2H3,(H,12,14)/t9-/m1/s1
InChIKeySNNREOOEKWTZGB-SECBINFHSA-N
MW263.36 g/mol
LogP-0.86
Rot. Bonds6

About 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide

2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide (PubChem CID 120654491) has the molecular formula C10H21N3O3S and a molecular weight of 263.36 g/mol. Its IUPAC name is 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide.

Molecular Properties

Compound Name2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide
PubChem CID120654491
Molecular FormulaC10H21N3O3S
Molecular Weight263.36 g/mol
Exact Mass263.13
IUPAC Name2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide
SMILESCCN[C@H](C)CNC(=O)CN1CCCS1(=O)=O
InChIInChI=1S/C10H21N3O3S/c1-3-11-9(2)7-12-10(14)8-13-5-4-6-17(13,15)16/h9,11H,3-8H2,1-2H3,(H,12,14)/t9-/m1/s1
InChIKeySNNREOOEKWTZGB-SECBINFHSA-N
XLogP-0.86
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.36
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-2-(1,1-dioxothiazinan-2-yl)acetamide
CID 110687638
2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)acetamide
CID 120811155
2-(1,1-dioxo-1,2-thiazolidin-2-yl)acetohydrazide
CID 14668524
2-[[2-(1,1-dioxo-1,2-thiazolidin-2-yl)acetyl]amino]-3-methylbutanoic acid
CID 119348327
2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(2-methylbutan-2-yl)acetamide
CID 47235152
3-[3-(1,1-dioxo-1,2-thiazolidin-2-yl)propanoylamino]-2-methylpropanoic acid
CID 119237341
N-[(4,4-difluorocyclohexyl)methyl]-2-(1,1-dioxo-1,2-thiazolidin-2-yl)acetamide
CID 136540557
2-(1,1-dioxothiazinan-2-yl)-N-(3-methoxypropyl)acetamide
CID 110687646
3-cyclohexyl-N-[(2R)-2-(ethylamino)propyl]butanamide
CID 120650989
N-butan-2-yl-3-(1,1-dioxothiazinan-2-yl)propanamide
CID 110687817
2-[[2-(1,1-dioxo-1,2-thiazolidin-2-yl)acetyl]-methylamino]propanoic acid
CID 119358530
2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]acetamide
CID 87000650

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide?
The IUPAC name of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide (CID 120654491) is 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide.
What is the SMILES notation for 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide?
The canonical SMILES for 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide is CCN[C@H](C)CNC(=O)CN1CCCS1(=O)=O.
What is the InChIKey of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide?
The InChIKey is SNNREOOEKWTZGB-SECBINFHSA-N. The full InChI is InChI=1S/C10H21N3O3S/c1-3-11-9(2)7-12-10(14)8-13-5-4-6-17(13,15)16/h9,11H,3-8H2,1-2H3,(H,12,14)/t9-/m1/s1.
What are the key properties of 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide?
2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide has a molecular weight of 263.36 g/mol, XLogP of -0.86, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-[(2R)-2-(ethylamino)propyl]acetamide is sourced from PubChem (CID 120654491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).