2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine

C10H15NS — CID 55294440

IUPAC2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine
SMILESCc1cc(C(N)CC2CC2)cs1
InChIInChI=1S/C10H15NS/c1-7-4-9(6-12-7)10(11)5-8-2-3-8/h4,6,8,10H,2-3,5,11H2,1H3
InChIKeyWUHFONAWGJMPJV-UHFFFAOYSA-N
MW181.30 g/mol
LogP2.86
Rot. Bonds3

About 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine

2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine (PubChem CID 55294440) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine
PubChem CID55294440
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC Name2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine
SMILESCc1cc(C(N)CC2CC2)cs1
InChIInChI=1S/C10H15NS/c1-7-4-9(6-12-7)10(11)5-8-2-3-8/h4,6,8,10H,2-3,5,11H2,1H3
InChIKeyWUHFONAWGJMPJV-UHFFFAOYSA-N
XLogP2.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine?
The IUPAC name of 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine (CID 55294440) is 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine?
The canonical SMILES for 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine is Cc1cc(C(N)CC2CC2)cs1.
What is the InChIKey of 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine?
The InChIKey is WUHFONAWGJMPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS/c1-7-4-9(6-12-7)10(11)5-8-2-3-8/h4,6,8,10H,2-3,5,11H2,1H3.
What are the key properties of 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine?
2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine has a molecular weight of 181.30 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(5-methylthiophen-3-yl)ethanamine is sourced from PubChem (CID 55294440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).