N-tert-butylthieno[3,2-c]pyridin-4-amine

C11H14N2S — CID 126975731

IUPACN-tert-butylthieno[3,2-c]pyridin-4-amine
SMILESCC(C)(C)Nc1nccc2sccc12
InChIInChI=1S/C11H14N2S/c1-11(2,3)13-10-8-5-7-14-9(8)4-6-12-10/h4-7H,1-3H3,(H,12,13)
InChIKeyXSXVGCCOWZTKST-UHFFFAOYSA-N
MW206.31 g/mol
LogP3.51
Rot. Bonds1

About N-tert-butylthieno[3,2-c]pyridin-4-amine

N-tert-butylthieno[3,2-c]pyridin-4-amine (PubChem CID 126975731) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is N-tert-butylthieno[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-tert-butylthieno[3,2-c]pyridin-4-amine
PubChem CID126975731
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC NameN-tert-butylthieno[3,2-c]pyridin-4-amine
SMILESCC(C)(C)Nc1nccc2sccc12
InChIInChI=1S/C11H14N2S/c1-11(2,3)13-10-8-5-7-14-9(8)4-6-12-10/h4-7H,1-3H3,(H,12,13)
InChIKeyXSXVGCCOWZTKST-UHFFFAOYSA-N
XLogP3.51
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-tert-butylthieno[3,2-c]pyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-tert-butylthieno[3,2-c]pyridin-4-amine?
The IUPAC name of N-tert-butylthieno[3,2-c]pyridin-4-amine (CID 126975731) is N-tert-butylthieno[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-tert-butylthieno[3,2-c]pyridin-4-amine?
The canonical SMILES for N-tert-butylthieno[3,2-c]pyridin-4-amine is CC(C)(C)Nc1nccc2sccc12.
What is the InChIKey of N-tert-butylthieno[3,2-c]pyridin-4-amine?
The InChIKey is XSXVGCCOWZTKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S/c1-11(2,3)13-10-8-5-7-14-9(8)4-6-12-10/h4-7H,1-3H3,(H,12,13).
What are the key properties of N-tert-butylthieno[3,2-c]pyridin-4-amine?
N-tert-butylthieno[3,2-c]pyridin-4-amine has a molecular weight of 206.31 g/mol, XLogP of 3.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butylthieno[3,2-c]pyridin-4-amine is sourced from PubChem (CID 126975731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).