N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine

C13H16N2S — CID 116864476

IUPACN-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine
SMILESCNc1csc(-c2ccc(C)c(C)c2C)n1
InChIInChI=1S/C13H16N2S/c1-8-5-6-11(10(3)9(8)2)13-15-12(14-4)7-16-13/h5-7,14H,1-4H3
InChIKeyGHZKJCRCKFFONK-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.78
Rot. Bonds2

About N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine

N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine (PubChem CID 116864476) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine.

Molecular Properties

Compound NameN-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine
PubChem CID116864476
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC NameN-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine
SMILESCNc1csc(-c2ccc(C)c(C)c2C)n1
InChIInChI=1S/C13H16N2S/c1-8-5-6-11(10(3)9(8)2)13-15-12(14-4)7-16-13/h5-7,14H,1-4H3
InChIKeyGHZKJCRCKFFONK-UHFFFAOYSA-N
XLogP3.78
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-yl]methanamine
CID 116868210
2-[2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-yl]propan-2-amine
CID 116888112
2-(4-methoxy-2,5-dimethylphenyl)-N-methyl-1,3-thiazol-4-amine
CID 116864413
3-[2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-yl]propan-1-amine
CID 116888287
N-methyl-2-(6-methyl-3-pyridinyl)-1,3-thiazol-4-amine
CID 71013426
2-amino-1-[2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-yl]ethanol
CID 116890712
2-(2-chloro-4-methoxyphenyl)-N-methyl-1,3-thiazol-4-amine
CID 116864439
5-(chloromethyl)-4-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazole
CID 116885359
4-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazole-5-carbaldehyde
CID 116885687
2-(4-ethoxy-3-methylphenyl)-N-methyl-1,3-thiazol-4-amine
CID 116864423
[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892119
4-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazole-5-carboxamide
CID 116887740

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine?
The IUPAC name of N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine (CID 116864476) is N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine.
What is the SMILES notation for N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine?
The canonical SMILES for N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine is CNc1csc(-c2ccc(C)c(C)c2C)n1.
What is the InChIKey of N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine?
The InChIKey is GHZKJCRCKFFONK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-8-5-6-11(10(3)9(8)2)13-15-12(14-4)7-16-13/h5-7,14H,1-4H3.
What are the key properties of N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine?
N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine has a molecular weight of 232.35 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-amine is sourced from PubChem (CID 116864476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).