N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine

C10H12N2S2 — CID 112642765

IUPACN-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine
SMILESCNC(Cc1cncs1)c1ccsc1
InChIInChI=1S/C10H12N2S2/c1-11-10(8-2-3-13-6-8)4-9-5-12-7-14-9/h2-3,5-7,10-11H,4H2,1H3
InChIKeyYDAMGKNXTJSEFV-UHFFFAOYSA-N
MW224.35 g/mol
LogP2.71
Rot. Bonds4

About N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine

N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine (PubChem CID 112642765) has the molecular formula C10H12N2S2 and a molecular weight of 224.35 g/mol. Its IUPAC name is N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine.

Molecular Properties

Compound NameN-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine
PubChem CID112642765
Molecular FormulaC10H12N2S2
Molecular Weight224.35 g/mol
Exact Mass224.04
IUPAC NameN-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine
SMILESCNC(Cc1cncs1)c1ccsc1
InChIInChI=1S/C10H12N2S2/c1-11-10(8-2-3-13-6-8)4-9-5-12-7-14-9/h2-3,5-7,10-11H,4H2,1H3
InChIKeyYDAMGKNXTJSEFV-UHFFFAOYSA-N
XLogP2.71
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-iodophenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 105030468
1-(4-fluorophenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642697
1-(4-ethylphenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642771
N-methyl-2-(1,3-thiazol-5-yl)-1-[4-(trifluoromethyl)phenyl]ethanamine
CID 105030333
N-methyl-1-(2-methyl-4-pyridinyl)-2-(1,3-thiazol-5-yl)ethanamine
CID 106755782
1-(3-chlorophenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 112642744
1-(3-chloro-5-methylphenyl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 105030810
1-(2-chlorofuran-3-yl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 106692940
2-(furan-2-yl)-N-methyl-1-thiophen-3-ylethanamine
CID 83175693
1-(3-chloro-4-methylthiophen-2-yl)-N-methyl-2-(1,3-thiazol-5-yl)ethanamine
CID 103407151
N-methyl-2-(1,3-thiazol-5-yl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105030553
N-methyl-1-(4-methylthiadiazol-5-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 105177948

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine?
The IUPAC name of N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine (CID 112642765) is N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine.
What is the SMILES notation for N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine?
The canonical SMILES for N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine is CNC(Cc1cncs1)c1ccsc1.
What is the InChIKey of N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine?
The InChIKey is YDAMGKNXTJSEFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2S2/c1-11-10(8-2-3-13-6-8)4-9-5-12-7-14-9/h2-3,5-7,10-11H,4H2,1H3.
What are the key properties of N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine?
N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine has a molecular weight of 224.35 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1,3-thiazol-5-yl)-1-thiophen-3-ylethanamine is sourced from PubChem (CID 112642765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).