N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine

C12H24N2O2S — CID 84595633

IUPACN-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine
SMILESCC1(C)CCCC1NCCN1CCCS1(=O)=O
InChIInChI=1S/C12H24N2O2S/c1-12(2)6-3-5-11(12)13-7-9-14-8-4-10-17(14,15)16/h11,13H,3-10H2,1-2H3
InChIKeyNXAOCMDDUYKSEF-UHFFFAOYSA-N
MW260.40 g/mol
LogP1.19
Rot. Bonds4

About N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine

N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine (PubChem CID 84595633) has the molecular formula C12H24N2O2S and a molecular weight of 260.40 g/mol. Its IUPAC name is N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine
PubChem CID84595633
Molecular FormulaC12H24N2O2S
Molecular Weight260.40 g/mol
Exact Mass260.16
IUPAC NameN-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine
SMILESCC1(C)CCCC1NCCN1CCCS1(=O)=O
InChIInChI=1S/C12H24N2O2S/c1-12(2)6-3-5-11(12)13-7-9-14-8-4-10-17(14,15)16/h11,13H,3-10H2,1-2H3
InChIKeyNXAOCMDDUYKSEF-UHFFFAOYSA-N
XLogP1.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine (CID 84595633) is N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine is CC1(C)CCCC1NCCN1CCCS1(=O)=O.
What is the InChIKey of N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine?
The InChIKey is NXAOCMDDUYKSEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2S/c1-12(2)6-3-5-11(12)13-7-9-14-8-4-10-17(14,15)16/h11,13H,3-10H2,1-2H3.
What are the key properties of N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine?
N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine has a molecular weight of 260.40 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethyl]-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 84595633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).