N-pentan-2-ylthieno[3,2-c]pyridin-4-amine

C12H16N2S — CID 43522745

IUPACN-pentan-2-ylthieno[3,2-c]pyridin-4-amine
SMILESCCCC(C)Nc1nccc2sccc12
InChIInChI=1S/C12H16N2S/c1-3-4-9(2)14-12-10-6-8-15-11(10)5-7-13-12/h5-9H,3-4H2,1-2H3,(H,13,14)
InChIKeyVGZYDRPVJSDCLE-UHFFFAOYSA-N
MW220.34 g/mol
LogP3.90
Rot. Bonds4

About N-pentan-2-ylthieno[3,2-c]pyridin-4-amine

N-pentan-2-ylthieno[3,2-c]pyridin-4-amine (PubChem CID 43522745) has the molecular formula C12H16N2S and a molecular weight of 220.34 g/mol. Its IUPAC name is N-pentan-2-ylthieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-pentan-2-ylthieno[3,2-c]pyridin-4-amine
PubChem CID43522745
Molecular FormulaC12H16N2S
Molecular Weight220.34 g/mol
Exact Mass220.10
IUPAC NameN-pentan-2-ylthieno[3,2-c]pyridin-4-amine
SMILESCCCC(C)Nc1nccc2sccc12
InChIInChI=1S/C12H16N2S/c1-3-4-9(2)14-12-10-6-8-15-11(10)5-7-13-12/h5-9H,3-4H2,1-2H3,(H,13,14)
InChIKeyVGZYDRPVJSDCLE-UHFFFAOYSA-N
XLogP3.90
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pentan-2-ylthieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-pentan-2-ylthieno[3,2-c]pyridin-4-amine (CID 43522745) is N-pentan-2-ylthieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-pentan-2-ylthieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-pentan-2-ylthieno[3,2-c]pyridin-4-amine is CCCC(C)Nc1nccc2sccc12.
What is the InChIKey of N-pentan-2-ylthieno[3,2-c]pyridin-4-amine?
The InChIKey is VGZYDRPVJSDCLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S/c1-3-4-9(2)14-12-10-6-8-15-11(10)5-7-13-12/h5-9H,3-4H2,1-2H3,(H,13,14).
What are the key properties of N-pentan-2-ylthieno[3,2-c]pyridin-4-amine?
N-pentan-2-ylthieno[3,2-c]pyridin-4-amine has a molecular weight of 220.34 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-ylthieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 43522745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).