2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine

C12H22N2S — CID 14872419

IUPAC2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine
SMILESCCN(CC)c1ccsc1N(CC)CC
InChIInChI=1S/C12H22N2S/c1-5-13(6-2)11-9-10-15-12(11)14(7-3)8-4/h9-10H,5-8H2,1-4H3
InChIKeyCUQXIFAMVIWJCA-UHFFFAOYSA-N
MW226.39 g/mol
LogP3.44
Rot. Bonds6

About 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine

2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine (PubChem CID 14872419) has the molecular formula C12H22N2S and a molecular weight of 226.39 g/mol. Its IUPAC name is 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine.

Molecular Properties

Compound Name2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine
PubChem CID14872419
Molecular FormulaC12H22N2S
Molecular Weight226.39 g/mol
Exact Mass226.15
IUPAC Name2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine
SMILESCCN(CC)c1ccsc1N(CC)CC
InChIInChI=1S/C12H22N2S/c1-5-13(6-2)11-9-10-15-12(11)14(7-3)8-4/h9-10H,5-8H2,1-4H3
InChIKeyCUQXIFAMVIWJCA-UHFFFAOYSA-N
XLogP3.44
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.39
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine?
The IUPAC name of 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine (CID 14872419) is 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine.
What is the SMILES notation for 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine?
The canonical SMILES for 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine is CCN(CC)c1ccsc1N(CC)CC.
What is the InChIKey of 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine?
The InChIKey is CUQXIFAMVIWJCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2S/c1-5-13(6-2)11-9-10-15-12(11)14(7-3)8-4/h9-10H,5-8H2,1-4H3.
What are the key properties of 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine?
2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine has a molecular weight of 226.39 g/mol, XLogP of 3.44, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,3-N,3-N-tetraethylthiophene-2,3-diamine is sourced from PubChem (CID 14872419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).