ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate

C15H18N2O2S — CID 18399709

IUPACethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(c2nccc3sccc23)CC1
InChIInChI=1S/C15H18N2O2S/c1-2-19-15(18)17-8-4-11(5-9-17)14-12-6-10-20-13(12)3-7-16-14/h3,6-7,10-11H,2,4-5,8-9H2,1H3
InChIKeyNOYXZXMWWGPCOU-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.63
Rot. Bonds2

About ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate

ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate (PubChem CID 18399709) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate
PubChem CID18399709
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC Nameethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(c2nccc3sccc23)CC1
InChIInChI=1S/C15H18N2O2S/c1-2-19-15(18)17-8-4-11(5-9-17)14-12-6-10-20-13(12)3-7-16-14/h3,6-7,10-11H,2,4-5,8-9H2,1H3
InChIKeyNOYXZXMWWGPCOU-UHFFFAOYSA-N
XLogP3.63
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[[4-(3-methoxy-2-pyridinyl)piperidin-1-yl]methyl]piperidine-1-carboxylate
CID 155518790
4-(1-ethoxyethenyl)thieno[3,2-c]pyridine
CID 135337046
ethyl 4-[[1-(1,3-thiazol-2-yl)piperidin-4-yl]amino]piperidine-1-carboxylate
CID 75519126
ethyl 4-(1-benzothiophen-5-ylamino)piperidine-1-carboxylate
CID 43781917
ethyl 4-[4-(5-methyl-1-benzothiophen-3-yl)piperidin-1-yl]piperidine-1-carboxylate
CID 11740879
ethyl 4-(4-pyridin-4-ylpiperidin-1-yl)piperidine-1-carboxylate
CID 78318993
ethyl 4-thieno[3,2-c]pyridin-4-ylbenzoate
CID 162519622
ethyl 4-(1,3-thiazol-2-ylcarbamoyl)piperazine-1-carboxylate
CID 47148348
ethyl 4-[1-(4-ethylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-4-carbonyl]piperazine-1-carboxylate
CID 5308985
ethyl 4-[[2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]piperidine-1-carboxylate
CID 34646688
ethyl 4-[(4-amino-2-pyridinyl)methyl]piperazine-1-carboxylate
CID 107877724
ethyl 4-[4-(4-methoxypyridazin-3-yl)piperidin-1-yl]azepane-1-carboxylate
CID 78318316

Frequently Asked Questions

What is the IUPAC name of ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate?
The IUPAC name of ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate (CID 18399709) is ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate?
The canonical SMILES for ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate is CCOC(=O)N1CCC(c2nccc3sccc23)CC1.
What is the InChIKey of ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate?
The InChIKey is NOYXZXMWWGPCOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-2-19-15(18)17-8-4-11(5-9-17)14-12-6-10-20-13(12)3-7-16-14/h3,6-7,10-11H,2,4-5,8-9H2,1H3.
What are the key properties of ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate?
ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate has a molecular weight of 290.39 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-thieno[3,2-c]pyridin-4-ylpiperidine-1-carboxylate is sourced from PubChem (CID 18399709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).