2-[(2-methoxyethylamino)methyl]thiophen-3-amine

C8H14N2OS — CID 66387291

IUPAC2-[(2-methoxyethylamino)methyl]thiophen-3-amine
SMILESCOCCNCc1sccc1N
InChIInChI=1S/C8H14N2OS/c1-11-4-3-10-6-8-7(9)2-5-12-8/h2,5,10H,3-4,6,9H2,1H3
InChIKeyNYNYOKBASUXAAH-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.07
Rot. Bonds5

About 2-[(2-methoxyethylamino)methyl]thiophen-3-amine

2-[(2-methoxyethylamino)methyl]thiophen-3-amine (PubChem CID 66387291) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is 2-[(2-methoxyethylamino)methyl]thiophen-3-amine.

Molecular Properties

Compound Name2-[(2-methoxyethylamino)methyl]thiophen-3-amine
PubChem CID66387291
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC Name2-[(2-methoxyethylamino)methyl]thiophen-3-amine
SMILESCOCCNCc1sccc1N
InChIInChI=1S/C8H14N2OS/c1-11-4-3-10-6-8-7(9)2-5-12-8/h2,5,10H,3-4,6,9H2,1H3
InChIKeyNYNYOKBASUXAAH-UHFFFAOYSA-N
XLogP1.07
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyethylamino)methyl]thiophen-3-amine?
The IUPAC name of 2-[(2-methoxyethylamino)methyl]thiophen-3-amine (CID 66387291) is 2-[(2-methoxyethylamino)methyl]thiophen-3-amine.
What is the SMILES notation for 2-[(2-methoxyethylamino)methyl]thiophen-3-amine?
The canonical SMILES for 2-[(2-methoxyethylamino)methyl]thiophen-3-amine is COCCNCc1sccc1N.
What is the InChIKey of 2-[(2-methoxyethylamino)methyl]thiophen-3-amine?
The InChIKey is NYNYOKBASUXAAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-11-4-3-10-6-8-7(9)2-5-12-8/h2,5,10H,3-4,6,9H2,1H3.
What are the key properties of 2-[(2-methoxyethylamino)methyl]thiophen-3-amine?
2-[(2-methoxyethylamino)methyl]thiophen-3-amine has a molecular weight of 186.28 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyethylamino)methyl]thiophen-3-amine is sourced from PubChem (CID 66387291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).