2-ethyl-3H-thiophen-2-amine

C6H11NS — CID 19777369

IUPAC2-ethyl-3H-thiophen-2-amine
SMILESCCC1(N)CC=CS1
InChIInChI=1S/C6H11NS/c1-2-6(7)4-3-5-8-6/h3,5H,2,4,7H2,1H3
InChIKeySOFBDTHKPFGJKU-UHFFFAOYSA-N
MW129.23 g/mol
LogP1.70
Rot. Bonds1

About 2-ethyl-3H-thiophen-2-amine

2-ethyl-3H-thiophen-2-amine (PubChem CID 19777369) has the molecular formula C6H11NS and a molecular weight of 129.23 g/mol. Its IUPAC name is 2-ethyl-3H-thiophen-2-amine.

Molecular Properties

Compound Name2-ethyl-3H-thiophen-2-amine
PubChem CID19777369
Molecular FormulaC6H11NS
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC Name2-ethyl-3H-thiophen-2-amine
SMILESCCC1(N)CC=CS1
InChIInChI=1S/C6H11NS/c1-2-6(7)4-3-5-8-6/h3,5H,2,4,7H2,1H3
InChIKeySOFBDTHKPFGJKU-UHFFFAOYSA-N
XLogP1.70
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3H-thiophen-2-amine?
The IUPAC name of 2-ethyl-3H-thiophen-2-amine (CID 19777369) is 2-ethyl-3H-thiophen-2-amine.
What is the SMILES notation for 2-ethyl-3H-thiophen-2-amine?
The canonical SMILES for 2-ethyl-3H-thiophen-2-amine is CCC1(N)CC=CS1.
What is the InChIKey of 2-ethyl-3H-thiophen-2-amine?
The InChIKey is SOFBDTHKPFGJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NS/c1-2-6(7)4-3-5-8-6/h3,5H,2,4,7H2,1H3.
What are the key properties of 2-ethyl-3H-thiophen-2-amine?
2-ethyl-3H-thiophen-2-amine has a molecular weight of 129.23 g/mol, XLogP of 1.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3H-thiophen-2-amine is sourced from PubChem (CID 19777369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).