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

C11H16N2O2S — CID 110460548

IUPACethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate
SMILESCCOC(=O)NCCc1nc2c(s1)CCC2
InChIInChI=1S/C11H16N2O2S/c1-2-15-11(14)12-7-6-10-13-8-4-3-5-9(8)16-10/h2-7H2,1H3,(H,12,14)
InChIKeyDZBPSZZKLVZMEZ-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.92
Rot. Bonds4

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

ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate (PubChem CID 110460548) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate
PubChem CID110460548
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Nameethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate
SMILESCCOC(=O)NCCc1nc2c(s1)CCC2
InChIInChI=1S/C11H16N2O2S/c1-2-15-11(14)12-7-6-10-13-8-4-3-5-9(8)16-10/h2-7H2,1H3,(H,12,14)
InChIKeyDZBPSZZKLVZMEZ-UHFFFAOYSA-N
XLogP1.92
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate?
The IUPAC name of ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate (CID 110460548) is ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate.
What is the SMILES notation for ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate?
The canonical SMILES for ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate is CCOC(=O)NCCc1nc2c(s1)CCC2.
What is the InChIKey of ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate?
The InChIKey is DZBPSZZKLVZMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-2-15-11(14)12-7-6-10-13-8-4-3-5-9(8)16-10/h2-7H2,1H3,(H,12,14).
What are the key properties of ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate?
ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate has a molecular weight of 240.33 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]carbamate is sourced from PubChem (CID 110460548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).