N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine

C12H14N2S — CID 4961253

IUPACN-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine
SMILESCNCc1sc(-c2ccccc2)nc1C
InChIInChI=1S/C12H14N2S/c1-9-11(8-13-2)15-12(14-9)10-6-4-3-5-7-10/h3-7,13H,8H2,1-2H3
InChIKeyGFAGRBRYZWAUSV-UHFFFAOYSA-N
MW218.33 g/mol
LogP2.84
Rot. Bonds3

About N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine

N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine (PubChem CID 4961253) has the molecular formula C12H14N2S and a molecular weight of 218.33 g/mol. Its IUPAC name is N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine
PubChem CID4961253
Molecular FormulaC12H14N2S
Molecular Weight218.33 g/mol
Exact Mass218.09
IUPAC NameN-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine
SMILESCNCc1sc(-c2ccccc2)nc1C
InChIInChI=1S/C12H14N2S/c1-9-11(8-13-2)15-12(14-9)10-6-4-3-5-7-10/h3-7,13H,8H2,1-2H3
InChIKeyGFAGRBRYZWAUSV-UHFFFAOYSA-N
XLogP2.84
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.33
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-4-phenyl-5-methylthiazole
CID 96129
2-Methyl-4-phenyl-1,3-thiazole
CID 584377
3-(2-Methyl-thiazol-4-yl)-phenylamine
CID 736535
2-Thiazolamine, 5-ethyl-4-phenyl-
CID 147560
2-(2-Methyl-3-phenylphenyl)-4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridine
CID 132085809
4-Methyl-2-Phenyl-1,3-Thiazole-5-Carboxamide
CID 737887
2-Methyl-4,5-diphenylthiazole
CID 77365
4-allyl-5-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-4H-1,2,4-triazol-3-ylhydrosulfide
CID 1475942
3-Ethyl-2-methyl-4,5-diphenyl-1,3-thiazol-3-ium iodide
CID 16194442
2-Methyl-4-(4-aminophenyl)thiazole
CID 152684
(2-Phenyl-1,3-thiazol-5-yl)methanamine
CID 595758
2-(4-Phenyl-1,3-thiazol-2-yl)ethanethioamide
CID 724012

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine (CID 4961253) is N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine is CNCc1sc(-c2ccccc2)nc1C.
What is the InChIKey of N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine?
The InChIKey is GFAGRBRYZWAUSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-9-11(8-13-2)15-12(14-9)10-6-4-3-5-7-10/h3-7,13H,8H2,1-2H3.
What are the key properties of N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine?
N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine has a molecular weight of 218.33 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanamine is sourced from PubChem (CID 4961253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).