N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide

C9H18N2O4S2 — CID 63251989

IUPACN-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide
SMILESNC1CCCC1NS(=O)(=O)C1CCS(=O)(=O)C1
InChIInChI=1S/C9H18N2O4S2/c10-8-2-1-3-9(8)11-17(14,15)7-4-5-16(12,13)6-7/h7-9,11H,1-6,10H2
InChIKeyRDBKQLGDFUCSDH-UHFFFAOYSA-N
MW282.39 g/mol
LogP-1.03
Rot. Bonds3

About N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide

N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide (PubChem CID 63251989) has the molecular formula C9H18N2O4S2 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide.

Molecular Properties

Compound NameN-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide
PubChem CID63251989
Molecular FormulaC9H18N2O4S2
Molecular Weight282.39 g/mol
Exact Mass282.07
IUPAC NameN-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide
SMILESNC1CCCC1NS(=O)(=O)C1CCS(=O)(=O)C1
InChIInChI=1S/C9H18N2O4S2/c10-8-2-1-3-9(8)11-17(14,15)7-4-5-16(12,13)6-7/h7-9,11H,1-6,10H2
InChIKeyRDBKQLGDFUCSDH-UHFFFAOYSA-N
XLogP-1.03
TPSA106.33 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-aminocyclopentyl)-1,1-dioxothiane-4-sulfonamide
CID 63252300
N-(2-aminocyclohexyl)-1,1-dioxothiane-4-sulfonamide
CID 62083890
1,1-dioxo-N-propan-2-ylthiolane-3-sulfonamide
CID 43827643
N-(2-bromocyclopentyl)-1,1-dioxothiane-4-sulfonamide
CID 80661845
N-(2-bromocyclohexyl)-1,1-dioxothiane-4-sulfonamide
CID 114297372
4-[(1,1-dioxothiolan-3-yl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 60807922
1,1-dioxo-N-[(3R)-pyrrolidin-3-yl]thiolane-3-sulfonamide
CID 79685893
1,1-dioxo-N-[2-(trifluoromethyl)cyclohexyl]thiane-4-sulfonamide
CID 51133233
N-[(2-hydroxycyclohexyl)methyl]-1,1-dioxothiolane-3-sulfonamide
CID 64913898
(3S)-1,1-dioxothiolane-3-sulfonate
CID 7088081
N-[(1-hydroxycyclopentyl)methyl]-1,1-dioxothiolane-3-sulfonamide
CID 65113372
N-(2-aminocycloheptyl)-1,1-dioxothiolane-3-carboxamide
CID 63257894

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide?
The IUPAC name of N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide (CID 63251989) is N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide.
What is the SMILES notation for N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide?
The canonical SMILES for N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide is NC1CCCC1NS(=O)(=O)C1CCS(=O)(=O)C1.
What is the InChIKey of N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide?
The InChIKey is RDBKQLGDFUCSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O4S2/c10-8-2-1-3-9(8)11-17(14,15)7-4-5-16(12,13)6-7/h7-9,11H,1-6,10H2.
What are the key properties of N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide?
N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide has a molecular weight of 282.39 g/mol, XLogP of -1.03, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopentyl)-1,1-dioxothiolane-3-sulfonamide is sourced from PubChem (CID 63251989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).