ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine

C12H18N2S — CID 142528478

IUPACethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine
SMILESCC.Cc1cc(C)c2c(N)c(C)sc2n1
InChIInChI=1S/C10H12N2S.C2H6/c1-5-4-6(2)12-10-8(5)9(11)7(3)13-10;1-2/h4H,11H2,1-3H3;1-2H3
InChIKeyFQKQYLOEZCUJKZ-UHFFFAOYSA-N
MW222.36 g/mol
LogP3.83
Rot. Bonds

About ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine

ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine (PubChem CID 142528478) has the molecular formula C12H18N2S and a molecular weight of 222.36 g/mol. Its IUPAC name is ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine.

Molecular Properties

Compound Nameethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine
PubChem CID142528478
Molecular FormulaC12H18N2S
Molecular Weight222.36 g/mol
Exact Mass222.12
IUPAC Nameethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine
SMILESCC.Cc1cc(C)c2c(N)c(C)sc2n1
InChIInChI=1S/C10H12N2S.C2H6/c1-5-4-6(2)12-10-8(5)9(11)7(3)13-10;1-2/h4H,11H2,1-3H3;1-2H3
InChIKeyFQKQYLOEZCUJKZ-UHFFFAOYSA-N
XLogP3.83
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine?
The IUPAC name of ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine (CID 142528478) is ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine.
What is the SMILES notation for ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine?
The canonical SMILES for ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine is CC.Cc1cc(C)c2c(N)c(C)sc2n1.
What is the InChIKey of ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine?
The InChIKey is FQKQYLOEZCUJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2S.C2H6/c1-5-4-6(2)12-10-8(5)9(11)7(3)13-10;1-2/h4H,11H2,1-3H3;1-2H3.
What are the key properties of ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine?
ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine has a molecular weight of 222.36 g/mol, XLogP of 3.83, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,4,6-trimethylthieno[2,3-b]pyridin-3-amine is sourced from PubChem (CID 142528478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).