N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine

C8H14N2S — CID 43755162

IUPACN-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
SMILESCCNC(C)c1scnc1C
InChIInChI=1S/C8H14N2S/c1-4-9-6(2)8-7(3)10-5-11-8/h5-6,9H,4H2,1-3H3
InChIKeyUCHIPDTXKBVNLU-UHFFFAOYSA-N
MW170.28 g/mol
LogP2.12
Rot. Bonds3

About N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine

N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine (PubChem CID 43755162) has the molecular formula C8H14N2S and a molecular weight of 170.28 g/mol. Its IUPAC name is N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
PubChem CID43755162
Molecular FormulaC8H14N2S
Molecular Weight170.28 g/mol
Exact Mass170.09
IUPAC NameN-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine
SMILESCCNC(C)c1scnc1C
InChIInChI=1S/C8H14N2S/c1-4-9-6(2)8-7(3)10-5-11-8/h5-6,9H,4H2,1-3H3
InChIKeyUCHIPDTXKBVNLU-UHFFFAOYSA-N
XLogP2.12
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.28
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
The IUPAC name of N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine (CID 43755162) is N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
The canonical SMILES for N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine is CCNC(C)c1scnc1C.
What is the InChIKey of N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
The InChIKey is UCHIPDTXKBVNLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2S/c1-4-9-6(2)8-7(3)10-5-11-8/h5-6,9H,4H2,1-3H3.
What are the key properties of N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine?
N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine has a molecular weight of 170.28 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)ethanamine is sourced from PubChem (CID 43755162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).