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

C7H12N2S — CID 54044139

IUPAC1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine
SMILESCNCc1sc(C)nc1C
InChIInChI=1S/C7H12N2S/c1-5-7(4-8-3)10-6(2)9-5/h8H,4H2,1-3H3
InChIKeyAMEJZNVARBMYKK-UHFFFAOYSA-N
MW156.25 g/mol
LogP1.48
Rot. Bonds2

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

1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine (PubChem CID 54044139) has the molecular formula C7H12N2S and a molecular weight of 156.25 g/mol. Its IUPAC name is 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine
PubChem CID54044139
Molecular FormulaC7H12N2S
Molecular Weight156.25 g/mol
Exact Mass156.07
IUPAC Name1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine
SMILESCNCc1sc(C)nc1C
InChIInChI=1S/C7H12N2S/c1-5-7(4-8-3)10-6(2)9-5/h8H,4H2,1-3H3
InChIKeyAMEJZNVARBMYKK-UHFFFAOYSA-N
XLogP1.48
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.25
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine (CID 54044139) is 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine is CNCc1sc(C)nc1C.
What is the InChIKey of 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine?
The InChIKey is AMEJZNVARBMYKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2S/c1-5-7(4-8-3)10-6(2)9-5/h8H,4H2,1-3H3.
What are the key properties of 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine?
1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine has a molecular weight of 156.25 g/mol, XLogP of 1.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethyl-1,3-thiazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 54044139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).