4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide

C14H21N5O2S2 — CID 91128293

IUPAC4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide
SMILESCCCc1cc(N2CCN(S(N)(=O)=O)CC2)nc2scc(N)c12
InChIInChI=1S/C14H21N5O2S2/c1-2-3-10-8-12(17-14-13(10)11(15)9-22-14)18-4-6-19(7-5-18)23(16,20)21/h8-9H,2-7,15H2,1H3,(H2,16,20,21)
InChIKeyOHOYVXYKCPHCFV-UHFFFAOYSA-N
MW355.49 g/mol
LogP1.16
Rot. Bonds4

About 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide

4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide (PubChem CID 91128293) has the molecular formula C14H21N5O2S2 and a molecular weight of 355.49 g/mol. Its IUPAC name is 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide.

Molecular Properties

Compound Name4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide
PubChem CID91128293
Molecular FormulaC14H21N5O2S2
Molecular Weight355.49 g/mol
Exact Mass355.11
IUPAC Name4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide
SMILESCCCc1cc(N2CCN(S(N)(=O)=O)CC2)nc2scc(N)c12
InChIInChI=1S/C14H21N5O2S2/c1-2-3-10-8-12(17-14-13(10)11(15)9-22-14)18-4-6-19(7-5-18)23(16,20)21/h8-9H,2-7,15H2,1H3,(H2,16,20,21)
InChIKeyOHOYVXYKCPHCFV-UHFFFAOYSA-N
XLogP1.16
TPSA105.55 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.49
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide with MolForge

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

Launch Full Analysis

Related Compounds

(2S)-2-amino-1-[4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazin-1-yl]propan-1-one
CID 141077744
6-[4-(methylamino)piperidin-1-yl]-4-propyl-2-tritiothieno[2,3-b]pyridin-3-amine
CID 91260202
3-amino-6-(1,1-dioxo-1,4-thiazinan-4-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23400921
3-amino-6-[4-[(2S)-2-aminopropanoyl]piperazin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 23400850
3-amino-6-[4-(dimethylamino)piperidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 22278580
tert-butyl 4-(3-amino-2-carbamoyl-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-carboxylate
CID 23401058
3-amino-6-(1,4-diazepan-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23400922
3-amino-6-[(3S)-3-aminopyrrolidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 23400853
3-amino-6-[(3R)-3-aminopyrrolidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 142776840
3-amino-6-(4-amino-4-cyanopiperidin-1-yl)-4-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23400987
3-amino-6-[4-(methylcarbamoylamino)piperidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxylic acid
CID 22278562
3-amino-6-[4-(2-hydroxyethylamino)piperidin-1-yl]-4-propylthieno[2,3-b]pyridine-2-carboxamide
CID 23400958

Frequently Asked Questions

What is the IUPAC name of 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide?
The IUPAC name of 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide (CID 91128293) is 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide.
What is the SMILES notation for 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide?
The canonical SMILES for 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide is CCCc1cc(N2CCN(S(N)(=O)=O)CC2)nc2scc(N)c12.
What is the InChIKey of 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide?
The InChIKey is OHOYVXYKCPHCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2S2/c1-2-3-10-8-12(17-14-13(10)11(15)9-22-14)18-4-6-19(7-5-18)23(16,20)21/h8-9H,2-7,15H2,1H3,(H2,16,20,21).
What are the key properties of 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide?
4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide has a molecular weight of 355.49 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-amino-4-propylthieno[2,3-b]pyridin-6-yl)piperazine-1-sulfonamide is sourced from PubChem (CID 91128293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).