1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine

C12H20N2S — CID 105015162

IUPAC1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine
SMILESCC1(C)C(C(N)Cc2nccs2)C1(C)C
InChIInChI=1S/C12H20N2S/c1-11(2)10(12(11,3)4)8(13)7-9-14-5-6-15-9/h5-6,8,10H,7,13H2,1-4H3
InChIKeyWBZQYBINSRSMGA-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.70
Rot. Bonds3

About 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine

1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine (PubChem CID 105015162) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine
PubChem CID105015162
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine
SMILESCC1(C)C(C(N)Cc2nccs2)C1(C)C
InChIInChI=1S/C12H20N2S/c1-11(2)10(12(11,3)4)8(13)7-9-14-5-6-15-9/h5-6,8,10H,7,13H2,1-4H3
InChIKeyWBZQYBINSRSMGA-UHFFFAOYSA-N
XLogP2.70
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine (CID 105015162) is 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine is CC1(C)C(C(N)Cc2nccs2)C1(C)C.
What is the InChIKey of 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine?
The InChIKey is WBZQYBINSRSMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-11(2)10(12(11,3)4)8(13)7-9-14-5-6-15-9/h5-6,8,10H,7,13H2,1-4H3.
What are the key properties of 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine?
1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine has a molecular weight of 224.37 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,3,3-tetramethylcyclopropyl)-2-(1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 105015162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).