4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide

C9H17N3O3S — CID 146082093

IUPAC4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(N2CCCS2(=O)=O)CC1
InChIInChI=1S/C9H17N3O3S/c10-9(13)11-5-2-8(3-6-11)12-4-1-7-16(12,14)15/h8H,1-7H2,(H2,10,13)
InChIKeyOXDHPQZHOIDMKM-UHFFFAOYSA-N
MW247.32 g/mol
LogP-0.44
Rot. Bonds1

About 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide

4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide (PubChem CID 146082093) has the molecular formula C9H17N3O3S and a molecular weight of 247.32 g/mol. Its IUPAC name is 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide
PubChem CID146082093
Molecular FormulaC9H17N3O3S
Molecular Weight247.32 g/mol
Exact Mass247.10
IUPAC Name4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide
SMILESNC(=O)N1CCC(N2CCCS2(=O)=O)CC1
InChIInChI=1S/C9H17N3O3S/c10-9(13)11-5-2-8(3-6-11)12-4-1-7-16(12,14)15/h8H,1-7H2,(H2,10,13)
InChIKeyOXDHPQZHOIDMKM-UHFFFAOYSA-N
XLogP-0.44
TPSA83.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]carbamic acid
CID 139369242
[4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-(3-fluoro-5-methylphenyl)methanone
CID 128716146
3-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclobutan-1-amine
CID 61349589
3-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexane-1-carboxylic acid
CID 63042627
2-(azepan-4-yl)-1,2-thiazolidine 1,1-dioxide
CID 103655491
2-(1-tert-butylpyrrolidin-3-yl)-1,2-thiazolidine 1,1-dioxide
CID 59641762
1-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidin-1-yl]-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
CID 154703711
4-sulfanylpiperidine-1-carboxamide
CID 165469353
4-cyclopentylpiperazine-1-carboxamide
CID 57205906
4-cyclobutylpiperazine-1-carboxamide
CID 53426578
2-cyclopropyl-1,2,5-thiadiazocane 1,1-dioxide
CID 117015210
2-(4-cyclopentyloxyphenyl)-1-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]ethanone
CID 58144646

Frequently Asked Questions

What is the IUPAC name of 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide?
The IUPAC name of 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide (CID 146082093) is 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide is NC(=O)N1CCC(N2CCCS2(=O)=O)CC1.
What is the InChIKey of 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide?
The InChIKey is OXDHPQZHOIDMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3S/c10-9(13)11-5-2-8(3-6-11)12-4-1-7-16(12,14)15/h8H,1-7H2,(H2,10,13).
What are the key properties of 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide?
4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide has a molecular weight of 247.32 g/mol, XLogP of -0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,1-dioxo-1,2-thiazolidin-2-yl)piperidine-1-carboxamide is sourced from PubChem (CID 146082093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).