1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine

C12H20N2S — CID 63355477

IUPAC1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine
SMILESCCNC(Cc1nc(CC)cs1)C1CC1
InChIInChI=1S/C12H20N2S/c1-3-10-8-15-12(14-10)7-11(13-4-2)9-5-6-9/h8-9,11,13H,3-7H2,1-2H3
InChIKeyHUQZKCRXNOHPHE-UHFFFAOYSA-N
MW224.37 g/mol
LogP2.64
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine

1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine (PubChem CID 63355477) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine
PubChem CID63355477
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine
SMILESCCNC(Cc1nc(CC)cs1)C1CC1
InChIInChI=1S/C12H20N2S/c1-3-10-8-15-12(14-10)7-11(13-4-2)9-5-6-9/h8-9,11,13H,3-7H2,1-2H3
InChIKeyHUQZKCRXNOHPHE-UHFFFAOYSA-N
XLogP2.64
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine (CID 63355477) is 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine is CCNC(Cc1nc(CC)cs1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine?
The InChIKey is HUQZKCRXNOHPHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-3-10-8-15-12(14-10)7-11(13-4-2)9-5-6-9/h8-9,11,13H,3-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine?
1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine has a molecular weight of 224.37 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 63355477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).