pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone

C16H15N3OS — CID 22577871

IUPACpyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone
SMILESO=C(c1sc2ncccc2c1-n1cccc1)N1CCCC1
InChIInChI=1S/C16H15N3OS/c20-16(19-10-3-4-11-19)14-13(18-8-1-2-9-18)12-6-5-7-17-15(12)21-14/h1-2,5-9H,3-4,10-11H2
InChIKeyIHYLDRAHMFLXKW-UHFFFAOYSA-N
MW297.38 g/mol
LogP3.32
Rot. Bonds2

About pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone

pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone (PubChem CID 22577871) has the molecular formula C16H15N3OS and a molecular weight of 297.38 g/mol. Its IUPAC name is pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone.

Molecular Properties

Compound Namepyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone
PubChem CID22577871
Molecular FormulaC16H15N3OS
Molecular Weight297.38 g/mol
Exact Mass297.09
IUPAC Namepyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone
SMILESO=C(c1sc2ncccc2c1-n1cccc1)N1CCCC1
InChIInChI=1S/C16H15N3OS/c20-16(19-10-3-4-11-19)14-13(18-8-1-2-9-18)12-6-5-7-17-15(12)21-14/h1-2,5-9H,3-4,10-11H2
InChIKeyIHYLDRAHMFLXKW-UHFFFAOYSA-N
XLogP3.32
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone 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

(4-pyrimidin-2-ylpiperazin-1-yl)-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone
CID 50800548
[3-(2,5-dimethylpyrrol-1-yl)thieno[2,3-b]pyridin-2-yl]-(4-phenylpiperazin-1-yl)methanone
CID 46353263
N-(2-methoxyethyl)-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide
CID 22577899
N-(4-carbamoylphenyl)-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide
CID 50838614
ethyl 1-[3-(2,5-dimethylpyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperidine-4-carboxylate
CID 46353257
N-[3-(4-propylpiperazin-1-yl)propyl]-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide
CID 46353222
N-[1-(1-adamantyl)ethyl]-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide
CID 50800554
N-(3-chloro-4-fluorophenyl)-3-pyrrol-1-ylthieno[2,3-b]pyridine-2-carboxamide
CID 50838618
(4-methylpiperazin-1-yl)-(3-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)methanone
CID 139653297
cyclopentyl-[(3S)-3-[2-(morpholine-4-carbonyl)thieno[2,3-b]pyridin-3-yl]pyrrolidin-1-yl]methanone
CID 124971996
3-amino-N-piperidin-1-ylthieno[2,3-b]pyridine-2-carboxamide
CID 83025024
(3-aminothieno[2,3-b]pyridin-2-yl)-(3-anilinopiperidin-1-yl)methanone
CID 155953760

Frequently Asked Questions

What is the IUPAC name of pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone?
The IUPAC name of pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone (CID 22577871) is pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone.
What is the SMILES notation for pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone?
The canonical SMILES for pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone is O=C(c1sc2ncccc2c1-n1cccc1)N1CCCC1.
What is the InChIKey of pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone?
The InChIKey is IHYLDRAHMFLXKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3OS/c20-16(19-10-3-4-11-19)14-13(18-8-1-2-9-18)12-6-5-7-17-15(12)21-14/h1-2,5-9H,3-4,10-11H2.
What are the key properties of pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone?
pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone has a molecular weight of 297.38 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrrolidin-1-yl-(3-pyrrol-1-ylthieno[2,3-b]pyridin-2-yl)methanone is sourced from PubChem (CID 22577871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).