(4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone

C14H18N2OS — CID 6619973

IUPAC(4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone
SMILESCCn1c(C(=O)N2CCCCC2)cc2sccc21
InChIInChI=1S/C14H18N2OS/c1-2-16-11-6-9-18-13(11)10-12(16)14(17)15-7-4-3-5-8-15/h6,9-10H,2-5,7-8H2,1H3
InChIKeyXKBOHGHFENCUIG-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.35
Rot. Bonds2

About (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone

(4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone (PubChem CID 6619973) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone
PubChem CID6619973
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name(4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone
SMILESCCn1c(C(=O)N2CCCCC2)cc2sccc21
InChIInChI=1S/C14H18N2OS/c1-2-16-11-6-9-18-13(11)10-12(16)14(17)15-7-4-3-5-8-15/h6,9-10H,2-5,7-8H2,1H3
InChIKeyXKBOHGHFENCUIG-UHFFFAOYSA-N
XLogP3.35
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone 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

1-phenyl-2-[5-(piperidine-1-carbonyl)thieno[3,2-b]pyrrol-4-yl]ethanone
CID 1428087
ethyl 4-[1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-4-carbonyl]piperazine-1-carboxylate
CID 5308985
1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)-N-(3-pyrrolidin-1-ylpropyl)piperidine-4-carboxamide
CID 20883520
N-(2,2-dimethoxyethyl)-1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-4-carboxamide
CID 82017354
N-(2,2-diethoxyethyl)-1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-4-carboxamide
CID 82017353
[1-[4-(cyclohexylmethyl)thieno[3,2-b]pyrrole-5-carbonyl]piperidin-4-yl]-(4-ethylpiperazin-1-yl)methanone
CID 58169025
N-[(1S)-1-(1-adamantyl)ethyl]-1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-4-carboxamide
CID 92667712
ethyl 4-[2-(azepan-1-yl)-2-oxoethyl]thieno[3,2-b]pyrrole-5-carboxylate
CID 1438890
2,3-dihydroindol-1-yl-(4-ethylthieno[3,2-b]pyrrol-5-yl)methanone
CID 20877144
[1-[4-(cyclohexylmethyl)thieno[3,2-b]pyrrole-5-carbonyl]piperidin-4-yl]-(4-methylpiperazin-1-yl)methanone
CID 67053657
N-butan-2-yl-4-ethylthieno[3,2-b]pyrrole-5-carboxamide
CID 75768805
ethyl 1-[4-[(4-methylphenyl)methyl]thieno[3,2-b]pyrrole-5-carbonyl]piperidine-3-carboxylate
CID 46038957

Frequently Asked Questions

What is the IUPAC name of (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone?
The IUPAC name of (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone (CID 6619973) is (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone is CCn1c(C(=O)N2CCCCC2)cc2sccc21.
What is the InChIKey of (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone?
The InChIKey is XKBOHGHFENCUIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-2-16-11-6-9-18-13(11)10-12(16)14(17)15-7-4-3-5-8-15/h6,9-10H,2-5,7-8H2,1H3.
What are the key properties of (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone?
(4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone has a molecular weight of 262.38 g/mol, XLogP of 3.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylthieno[3,2-b]pyrrol-5-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 6619973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).