1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine

C11H17NS — CID 112715447

IUPAC1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine
SMILESCCc1cc2c(s1)CCC2C(C)N
InChIInChI=1S/C11H17NS/c1-3-8-6-10-9(7(2)12)4-5-11(10)13-8/h6-7,9H,3-5,12H2,1-2H3
InChIKeyKZFUORRKHUBVCM-UHFFFAOYSA-N
MW195.33 g/mol
LogP2.69
Rot. Bonds2

About 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine

1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine (PubChem CID 112715447) has the molecular formula C11H17NS and a molecular weight of 195.33 g/mol. Its IUPAC name is 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine.

Molecular Properties

Compound Name1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine
PubChem CID112715447
Molecular FormulaC11H17NS
Molecular Weight195.33 g/mol
Exact Mass195.11
IUPAC Name1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine
SMILESCCc1cc2c(s1)CCC2C(C)N
InChIInChI=1S/C11H17NS/c1-3-8-6-10-9(7(2)12)4-5-11(10)13-8/h6-7,9H,3-5,12H2,1-2H3
InChIKeyKZFUORRKHUBVCM-UHFFFAOYSA-N
XLogP2.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.33
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine?
The IUPAC name of 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine (CID 112715447) is 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine.
What is the SMILES notation for 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine?
The canonical SMILES for 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine is CCc1cc2c(s1)CCC2C(C)N.
What is the InChIKey of 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine?
The InChIKey is KZFUORRKHUBVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NS/c1-3-8-6-10-9(7(2)12)4-5-11(10)13-8/h6-7,9H,3-5,12H2,1-2H3.
What are the key properties of 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine?
1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine has a molecular weight of 195.33 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-5,6-dihydro-4H-cyclopenta[b]thiophen-4-yl)ethanamine is sourced from PubChem (CID 112715447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).