N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine

C11H14N2S2 — CID 115089122

IUPACN-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine
SMILESCNCCc1csc(-c2ccc(C)s2)n1
InChIInChI=1S/C11H14N2S2/c1-8-3-4-10(15-8)11-13-9(7-14-11)5-6-12-2/h3-4,7,12H,5-6H2,1-2H3
InChIKeyNHDGINYWMOUVON-UHFFFAOYSA-N
MW238.38 g/mol
LogP2.94
Rot. Bonds4

About N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine

N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine (PubChem CID 115089122) has the molecular formula C11H14N2S2 and a molecular weight of 238.38 g/mol. Its IUPAC name is N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine
PubChem CID115089122
Molecular FormulaC11H14N2S2
Molecular Weight238.38 g/mol
Exact Mass238.06
IUPAC NameN-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine
SMILESCNCCc1csc(-c2ccc(C)s2)n1
InChIInChI=1S/C11H14N2S2/c1-8-3-4-10(15-8)11-13-9(7-14-11)5-6-12-2/h3-4,7,12H,5-6H2,1-2H3
InChIKeyNHDGINYWMOUVON-UHFFFAOYSA-N
XLogP2.94
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.38
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanol
CID 115089075
2-[2-(5-bromo-2-methylphenyl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116888139
1-[2-(5-chlorothiophen-2-yl)-1,3-thiazol-4-yl]-N-methylmethanamine
CID 61281842
2-[2-(5-bromofuran-2-yl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 115089119
2-[2-(5-chlorofuran-2-yl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 115089115
2-[2-(2,5-difluorophenyl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 114275577
2-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116888129
2-[2-(1-benzofuran-3-yl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116888140
3-[2-(2,5-dimethylphenyl)-1,3-thiazol-4-yl]-N-methylpropan-1-amine
CID 116888293
2-[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]-N-methylethanamine
CID 116888128
N-methyl-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanamine
CID 18758998
N-[2-[2-(2-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-5-methylthiophene-2-sulfonamide
CID 110317199

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine?
The IUPAC name of N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine (CID 115089122) is N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine?
The canonical SMILES for N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine is CNCCc1csc(-c2ccc(C)s2)n1.
What is the InChIKey of N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine?
The InChIKey is NHDGINYWMOUVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S2/c1-8-3-4-10(15-8)11-13-9(7-14-11)5-6-12-2/h3-4,7,12H,5-6H2,1-2H3.
What are the key properties of N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine?
N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine has a molecular weight of 238.38 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-(5-methylthiophen-2-yl)-1,3-thiazol-4-yl]ethanamine is sourced from PubChem (CID 115089122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).