3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide

C16H22N4O2S — CID 23401001

IUPAC3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide
SMILESCCCc1cc(N2CCC(O)CC2)nc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C16H22N4O2S/c1-2-3-9-8-11(20-6-4-10(21)5-7-20)19-16-12(9)13(17)14(23-16)15(18)22/h8,10,21H,2-7,17H2,1H3,(H2,18,22)
InChIKeyFTSQTLCAVRPYJK-UHFFFAOYSA-N
MW334.45 g/mol
LogP1.89
Rot. Bonds4

About 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide

3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 23401001) has the molecular formula C16H22N4O2S and a molecular weight of 334.45 g/mol. Its IUPAC name is 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide
PubChem CID23401001
Molecular FormulaC16H22N4O2S
Molecular Weight334.45 g/mol
Exact Mass334.15
IUPAC Name3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide
SMILESCCCc1cc(N2CCC(O)CC2)nc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C16H22N4O2S/c1-2-3-9-8-11(20-6-4-10(21)5-7-20)19-16-12(9)13(17)14(23-16)15(18)22/h8,10,21H,2-7,17H2,1H3,(H2,18,22)
InChIKeyFTSQTLCAVRPYJK-UHFFFAOYSA-N
XLogP1.89
TPSA105.47 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.45
LogP ≤ 51.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide 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 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide (CID 23401001) is 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide is CCCc1cc(N2CCC(O)CC2)nc2sc(C(N)=O)c(N)c12.
What is the InChIKey of 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is FTSQTLCAVRPYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O2S/c1-2-3-9-8-11(20-6-4-10(21)5-7-20)19-16-12(9)13(17)14(23-16)15(18)22/h8,10,21H,2-7,17H2,1H3,(H2,18,22).
What are the key properties of 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide?
3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 334.45 g/mol, XLogP of 1.89, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 23401001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).