2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine

C11H18N2S — CID 83885178

IUPAC2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine
SMILESCC(C)c1nc2c(s1)CCC2CCN
InChIInChI=1S/C11H18N2S/c1-7(2)11-13-10-8(5-6-12)3-4-9(10)14-11/h7-8H,3-6,12H2,1-2H3
InChIKeyAEMMNNDEGXRWJK-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.65
Rot. Bonds3

About 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine

2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine (PubChem CID 83885178) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine
PubChem CID83885178
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine
SMILESCC(C)c1nc2c(s1)CCC2CCN
InChIInChI=1S/C11H18N2S/c1-7(2)11-13-10-8(5-6-12)3-4-9(10)14-11/h7-8H,3-6,12H2,1-2H3
InChIKeyAEMMNNDEGXRWJK-UHFFFAOYSA-N
XLogP2.65
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine?
The IUPAC name of 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine (CID 83885178) is 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine.
What is the SMILES notation for 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine?
The canonical SMILES for 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine is CC(C)c1nc2c(s1)CCC2CCN.
What is the InChIKey of 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine?
The InChIKey is AEMMNNDEGXRWJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-7(2)11-13-10-8(5-6-12)3-4-9(10)14-11/h7-8H,3-6,12H2,1-2H3.
What are the key properties of 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine?
2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine has a molecular weight of 210.35 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-4-yl)ethanamine is sourced from PubChem (CID 83885178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).