N-(2-aminoethyl)-N-thiophen-3-ylacetamide

C8H12N2OS — CID 18761095

IUPACN-(2-aminoethyl)-N-thiophen-3-ylacetamide
SMILESCC(=O)N(CCN)c1ccsc1
InChIInChI=1S/C8H12N2OS/c1-7(11)10(4-3-9)8-2-5-12-6-8/h2,5-6H,3-4,9H2,1H3
InChIKeyNUEVSHBPZNZOSC-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.06
Rot. Bonds3

About N-(2-aminoethyl)-N-thiophen-3-ylacetamide

N-(2-aminoethyl)-N-thiophen-3-ylacetamide (PubChem CID 18761095) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-thiophen-3-ylacetamide
PubChem CID18761095
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC NameN-(2-aminoethyl)-N-thiophen-3-ylacetamide
SMILESCC(=O)N(CCN)c1ccsc1
InChIInChI=1S/C8H12N2OS/c1-7(11)10(4-3-9)8-2-5-12-6-8/h2,5-6H,3-4,9H2,1H3
InChIKeyNUEVSHBPZNZOSC-UHFFFAOYSA-N
XLogP1.06
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-thiophen-3-ylacetamide?
The IUPAC name of N-(2-aminoethyl)-N-thiophen-3-ylacetamide (CID 18761095) is N-(2-aminoethyl)-N-thiophen-3-ylacetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-thiophen-3-ylacetamide?
The canonical SMILES for N-(2-aminoethyl)-N-thiophen-3-ylacetamide is CC(=O)N(CCN)c1ccsc1.
What is the InChIKey of N-(2-aminoethyl)-N-thiophen-3-ylacetamide?
The InChIKey is NUEVSHBPZNZOSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-7(11)10(4-3-9)8-2-5-12-6-8/h2,5-6H,3-4,9H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-thiophen-3-ylacetamide?
N-(2-aminoethyl)-N-thiophen-3-ylacetamide has a molecular weight of 184.26 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-thiophen-3-ylacetamide is sourced from PubChem (CID 18761095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).