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

C17H20N2S — CID 61332218

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine
SMILESCCNC1(c2nc3c(s2)CCC3)Cc2ccccc2C1
InChIInChI=1S/C17H20N2S/c1-2-18-17(10-12-6-3-4-7-13(12)11-17)16-19-14-8-5-9-15(14)20-16/h3-4,6-7,18H,2,5,8-11H2,1H3
InChIKeyJCNHZVWFECXBOI-UHFFFAOYSA-N
MW284.43 g/mol
LogP3.24
Rot. Bonds3

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

2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine (PubChem CID 61332218) has the molecular formula C17H20N2S and a molecular weight of 284.43 g/mol. Its IUPAC name is 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine.

Molecular Properties

Compound Name2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine
PubChem CID61332218
Molecular FormulaC17H20N2S
Molecular Weight284.43 g/mol
Exact Mass284.13
IUPAC Name2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine
SMILESCCNC1(c2nc3c(s2)CCC3)Cc2ccccc2C1
InChIInChI=1S/C17H20N2S/c1-2-18-17(10-12-6-3-4-7-13(12)11-17)16-19-14-8-5-9-15(14)20-16/h3-4,6-7,18H,2,5,8-11H2,1H3
InChIKeyJCNHZVWFECXBOI-UHFFFAOYSA-N
XLogP3.24
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine?
The IUPAC name of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine (CID 61332218) is 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine.
What is the SMILES notation for 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine?
The canonical SMILES for 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine is CCNC1(c2nc3c(s2)CCC3)Cc2ccccc2C1.
What is the InChIKey of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine?
The InChIKey is JCNHZVWFECXBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2S/c1-2-18-17(10-12-6-3-4-7-13(12)11-17)16-19-14-8-5-9-15(14)20-16/h3-4,6-7,18H,2,5,8-11H2,1H3.
What are the key properties of 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine?
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine has a molecular weight of 284.43 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-ethyl-1,3-dihydroinden-2-amine is sourced from PubChem (CID 61332218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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