1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine

C7H12N2S — CID 82416064

IUPAC1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine
SMILESCc1snc(C(C)N)c1C
InChIInChI=1S/C7H12N2S/c1-4-6(3)10-9-7(4)5(2)8/h5H,8H2,1-3H3
InChIKeyJYZXIWYBGUAROI-UHFFFAOYSA-N
MW156.25 g/mol
LogP1.78
Rot. Bonds1

About 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine

1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine (PubChem CID 82416064) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine.

Molecular Properties

Compound Name1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine
PubChem CID82416064
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC Name1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine
SMILESCc1snc(C(C)N)c1C
InChIInChI=1S/C7H12N2S/c1-4-6(3)10-9-7(4)5(2)8/h5H,8H2,1-3H3
InChIKeyJYZXIWYBGUAROI-UHFFFAOYSA-N
XLogP1.78
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4,5-trimethyl-1,2-thiazole
CID 581460
4-(1-aminoethyl)-5-methyl-1,3-thiazol-2-amine
CID 127003453
1-(3,4-dimethyl-2-pyridinyl)ethanamine;hydrochloride
CID 175402454
1-(2,5-dimethyl-1,3-oxazol-4-yl)ethanamine;hydrochloride
CID 155943307
1-(1,4,5-trimethylpyrazol-3-yl)ethanamine
CID 82595274
1-(3-methyl-2-pyridinyl)ethanamine;dihydrochloride
CID 127264674
(1R)-1-(1,4-dimethylpyrazol-3-yl)ethanamine;hydrochloride
CID 130454077
1-(2,5-dimethyltriazol-4-yl)ethanamine
CID 82594205
1-(2,4-dimethyl-1,3-thiazol-5-yl)ethanamine
CID 19805509
1-(6-ethyl-5-methylpyrimidin-4-yl)ethanamine
CID 82414481
2-[4-(1-aminoethyl)-5-methyl-1,3-thiazol-2-yl]-2-methylpropanenitrile
CID 131021040
5-(1-aminoethyl)-4-methyl-1,3-thiazol-2-amine
CID 61295642

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine?
The IUPAC name of 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine (CID 82416064) is 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine.
What is the SMILES notation for 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine?
The canonical SMILES for 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine is Cc1snc(C(C)N)c1C.
What is the InChIKey of 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine?
The InChIKey is JYZXIWYBGUAROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2S/c1-4-6(3)10-9-7(4)5(2)8/h5H,8H2,1-3H3.
What are the key properties of 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine?
1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine has a molecular weight of 156.25 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethyl-1,2-thiazol-3-yl)ethanamine is sourced from PubChem (CID 82416064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).