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

C12H14N2S — CID 60723741

IUPAC4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
SMILESCc1csc(NCc2ccccc2C)n1
InChIInChI=1S/C12H14N2S/c1-9-5-3-4-6-11(9)7-13-12-14-10(2)8-15-12/h3-6,8H,7H2,1-2H3,(H,13,14)
InChIKeyVQGUVNLOXISVLG-UHFFFAOYSA-N
MW218.32 g/mol
LogP3.37
Rot. Bonds3

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

4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine (PubChem CID 60723741) has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol. Its IUPAC name is 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
PubChem CID60723741
Molecular FormulaC12H14N2S
Molecular Weight218.32 g/mol
Exact Mass218.09
IUPAC Name4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
SMILESCc1csc(NCc2ccccc2C)n1
InChIInChI=1S/C12H14N2S/c1-9-5-3-4-6-11(9)7-13-12-14-10(2)8-15-12/h3-6,8H,7H2,1-2H3,(H,13,14)
InChIKeyVQGUVNLOXISVLG-UHFFFAOYSA-N
XLogP3.37
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-methyl-N-[(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

Related Compounds

4-(2-aminoethyl)-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine
CID 28710900
2-[(2-methylphenyl)methylamino]-N-(4-methyl-1,3-thiazol-2-yl)pyrimidine-5-carboxamide
CID 145489207
5-bromo-N-[(2-methylphenyl)methyl]-1,3,4-thiadiazol-2-amine
CID 64625511
N-[(2-methylphenyl)methyl]-1,3-benzothiazol-2-amine
CID 32680270
2-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]benzoic acid
CID 104601339
N-[(2,4-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 63363217
N-[(4-methoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 10728405
N-[(2-methylphenyl)methyl]-5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
CID 113353604
1-N,4-N-bis[(2-methylphenyl)methyl]benzene-1,4-diamine
CID 102345817
N-[[3-(methoxymethyl)phenyl]methyl]-4-methyl-1,3-thiazol-2-amine
CID 54896746
2-methyl-N-[(2-methylphenyl)methyl]quinolin-8-amine
CID 62954281
4-methyl-N-[(1-methylpyrazol-3-yl)methyl]-1,3-thiazol-2-amine
CID 82873661

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine (CID 60723741) is 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine is Cc1csc(NCc2ccccc2C)n1.
What is the InChIKey of 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
The InChIKey is VQGUVNLOXISVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-9-5-3-4-6-11(9)7-13-12-14-10(2)8-15-12/h3-6,8H,7H2,1-2H3,(H,13,14).
What are the key properties of 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine?
4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine has a molecular weight of 218.32 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[(2-methylphenyl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 60723741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).