2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide

C9H18N2O2S — CID 130582026

IUPAC2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide
SMILESCS(C)(=O)=NC(=O)CC1(N)CCCC1
InChIInChI=1S/C9H18N2O2S/c1-14(2,13)11-8(12)7-9(10)5-3-4-6-9/h3-7,10H2,1-2H3
InChIKeyJKRQSFSPVCOPHF-UHFFFAOYSA-N
MW218.32 g/mol
LogP0.90
Rot. Bonds2

About 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide

2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide (PubChem CID 130582026) has the molecular formula C9H18N2O2S and a molecular weight of 218.32 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide
PubChem CID130582026
Molecular FormulaC9H18N2O2S
Molecular Weight218.32 g/mol
Exact Mass218.11
IUPAC Name2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide
SMILESCS(C)(=O)=NC(=O)CC1(N)CCCC1
InChIInChI=1S/C9H18N2O2S/c1-14(2,13)11-8(12)7-9(10)5-3-4-6-9/h3-7,10H2,1-2H3
InChIKeyJKRQSFSPVCOPHF-UHFFFAOYSA-N
XLogP0.90
TPSA72.52 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide (CID 130582026) is 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide is CS(C)(=O)=NC(=O)CC1(N)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide?
The InChIKey is JKRQSFSPVCOPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2S/c1-14(2,13)11-8(12)7-9(10)5-3-4-6-9/h3-7,10H2,1-2H3.
What are the key properties of 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide?
2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide has a molecular weight of 218.32 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-[dimethyl(oxo)-λ6-sulfanylidene]acetamide is sourced from PubChem (CID 130582026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).