2-(3-methylthiophen-2-yl)ethanamine

C7H11NS — CID 14361750

IUPAC2-(3-methylthiophen-2-yl)ethanamine
SMILESCc1ccsc1CCN
InChIInChI=1S/C7H11NS/c1-6-3-5-9-7(6)2-4-8/h3,5H,2,4,8H2,1H3
InChIKeyCUXLLWPAXDMLLX-UHFFFAOYSA-N
MW141.24 g/mol
LogP1.56
Rot. Bonds2

About 2-(3-methylthiophen-2-yl)ethanamine

2-(3-methylthiophen-2-yl)ethanamine (PubChem CID 14361750) has the molecular formula C7H11NS and a molecular weight of 141.24 g/mol. Its IUPAC name is 2-(3-methylthiophen-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methylthiophen-2-yl)ethanamine
PubChem CID14361750
Molecular FormulaC7H11NS
Molecular Weight141.24 g/mol
Exact Mass141.06
IUPAC Name2-(3-methylthiophen-2-yl)ethanamine
SMILESCc1ccsc1CCN
InChIInChI=1S/C7H11NS/c1-6-3-5-9-7(6)2-4-8/h3,5H,2,4,8H2,1H3
InChIKeyCUXLLWPAXDMLLX-UHFFFAOYSA-N
XLogP1.56
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.24
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylthiophen-2-yl)ethanamine?
The IUPAC name of 2-(3-methylthiophen-2-yl)ethanamine (CID 14361750) is 2-(3-methylthiophen-2-yl)ethanamine.
What is the SMILES notation for 2-(3-methylthiophen-2-yl)ethanamine?
The canonical SMILES for 2-(3-methylthiophen-2-yl)ethanamine is Cc1ccsc1CCN.
What is the InChIKey of 2-(3-methylthiophen-2-yl)ethanamine?
The InChIKey is CUXLLWPAXDMLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NS/c1-6-3-5-9-7(6)2-4-8/h3,5H,2,4,8H2,1H3.
What are the key properties of 2-(3-methylthiophen-2-yl)ethanamine?
2-(3-methylthiophen-2-yl)ethanamine has a molecular weight of 141.24 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylthiophen-2-yl)ethanamine is sourced from PubChem (CID 14361750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).