N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide

C11H16N2O2S — CID 110460501

IUPACN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide
SMILESCOCC(=O)NCCc1nc2c(s1)CCC2
InChIInChI=1S/C11H16N2O2S/c1-15-7-10(14)12-6-5-11-13-8-3-2-4-9(8)16-11/h2-7H2,1H3,(H,12,14)
InChIKeyIOZQPAWARKAOTQ-UHFFFAOYSA-N
MW240.33 g/mol
LogP0.94
Rot. Bonds5

About N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide

N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide (PubChem CID 110460501) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide
PubChem CID110460501
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC NameN-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide
SMILESCOCC(=O)NCCc1nc2c(s1)CCC2
InChIInChI=1S/C11H16N2O2S/c1-15-7-10(14)12-6-5-11-13-8-3-2-4-9(8)16-11/h2-7H2,1H3,(H,12,14)
InChIKeyIOZQPAWARKAOTQ-UHFFFAOYSA-N
XLogP0.94
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide?
The IUPAC name of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide (CID 110460501) is N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide.
What is the SMILES notation for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide?
The canonical SMILES for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide is COCC(=O)NCCc1nc2c(s1)CCC2.
What is the InChIKey of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide?
The InChIKey is IOZQPAWARKAOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-15-7-10(14)12-6-5-11-13-8-3-2-4-9(8)16-11/h2-7H2,1H3,(H,12,14).
What are the key properties of N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide?
N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide has a molecular weight of 240.33 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-2-methoxyacetamide is sourced from PubChem (CID 110460501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).