4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine

C12H14N2S — CID 43431840

IUPAC4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
SMILESCc1ccccc1Cc1sc(N)nc1C
InChIInChI=1S/C12H14N2S/c1-8-5-3-4-6-10(8)7-11-9(2)14-12(13)15-11/h3-6H,7H2,1-2H3,(H2,13,14)
InChIKeyFYWUMXUTQKGQTR-UHFFFAOYSA-N
MW218.32 g/mol
LogP2.93
Rot. Bonds2

About 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine

4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine (PubChem CID 43431840) has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol. Its IUPAC name is 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
PubChem CID43431840
Molecular FormulaC12H14N2S
Molecular Weight218.32 g/mol
Exact Mass218.09
IUPAC Name4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
SMILESCc1ccccc1Cc1sc(N)nc1C
InChIInChI=1S/C12H14N2S/c1-8-5-3-4-6-10(8)7-11-9(2)14-12(13)15-11/h3-6H,7H2,1-2H3,(H2,13,14)
InChIKeyFYWUMXUTQKGQTR-UHFFFAOYSA-N
XLogP2.93
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine (CID 43431840) is 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine is Cc1ccccc1Cc1sc(N)nc1C.
What is the InChIKey of 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The InChIKey is FYWUMXUTQKGQTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-8-5-3-4-6-10(8)7-11-9(2)14-12(13)15-11/h3-6H,7H2,1-2H3,(H2,13,14).
What are the key properties of 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine has a molecular weight of 218.32 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 43431840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).