6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde

C13H14N2OS — CID 170747715

IUPAC6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde
SMILESO=Cc1cc2ccc(C3CCNCC3)nc2s1
InChIInChI=1S/C13H14N2OS/c16-8-11-7-10-1-2-12(15-13(10)17-11)9-3-5-14-6-4-9/h1-2,7-9,14H,3-6H2
InChIKeyOFJUPNRCLDUMPO-UHFFFAOYSA-N
MW246.33 g/mol
LogP2.58
Rot. Bonds2

About 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde

6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde (PubChem CID 170747715) has the molecular formula C13H14N2OS and a molecular weight of 246.33 g/mol. Its IUPAC name is 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde
PubChem CID170747715
Molecular FormulaC13H14N2OS
Molecular Weight246.33 g/mol
Exact Mass246.08
IUPAC Name6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde
SMILESO=Cc1cc2ccc(C3CCNCC3)nc2s1
InChIInChI=1S/C13H14N2OS/c16-8-11-7-10-1-2-12(15-13(10)17-11)9-3-5-14-6-4-9/h1-2,7-9,14H,3-6H2
InChIKeyOFJUPNRCLDUMPO-UHFFFAOYSA-N
XLogP2.58
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

6-(1-methylpiperidin-3-yl)thieno[2,3-b]pyridine-2-carbaldehyde
CID 170747425
2-pyrrolidin-3-yl-1,3-thiazole-5-carbaldehyde
CID 115089760
formamide;2-methyl-6-(1-methylpiperidin-3-yl)thieno[2,3-b]pyridine
CID 177202390
2-piperidin-4-yl-1,3-benzothiazole-6-carbaldehyde
CID 169226523
5-(3-piperidin-4-yltriazol-4-yl)thiophene-2-carbaldehyde
CID 165488291
6-piperidin-4-ylpyridazin-3-amine
CID 117105175
3-amino-6-piperidin-4-ylpyridine-2-carboxylic acid
CID 115032604
3-cyclopropyl-1,2-thiazole-5-carbaldehyde
CID 82416851
2-piperidin-4-ylquinoline-8-carboxamide
CID 175300888
4-cyclobutyl-6-piperidin-4-ylpyrimidine
CID 83849257
2-piperidin-4-yl-8-(trifluoromethyl)quinoline
CID 70241298
N-methyl-6-piperidin-4-ylpyridine-3-carboxamide
CID 73440684

Frequently Asked Questions

What is the IUPAC name of 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde?
The IUPAC name of 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde (CID 170747715) is 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde.
What is the SMILES notation for 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde?
The canonical SMILES for 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde is O=Cc1cc2ccc(C3CCNCC3)nc2s1.
What is the InChIKey of 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde?
The InChIKey is OFJUPNRCLDUMPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2OS/c16-8-11-7-10-1-2-12(15-13(10)17-11)9-3-5-14-6-4-9/h1-2,7-9,14H,3-6H2.
What are the key properties of 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde?
6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde has a molecular weight of 246.33 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-4-ylthieno[2,3-b]pyridine-2-carbaldehyde is sourced from PubChem (CID 170747715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).