ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate

C14H20N2O3 — CID 62348809

IUPACethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
SMILESCCOC(=O)c1ccc(OCC2CCNCC2)nc1
InChIInChI=1S/C14H20N2O3/c1-2-18-14(17)12-3-4-13(16-9-12)19-10-11-5-7-15-8-6-11/h3-4,9,11,15H,2,5-8,10H2,1H3
InChIKeyLTRRBEUMKUHMGX-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.64
Rot. Bonds5

About ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate

ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate (PubChem CID 62348809) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
PubChem CID62348809
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Nameethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
SMILESCCOC(=O)c1ccc(OCC2CCNCC2)nc1
InChIInChI=1S/C14H20N2O3/c1-2-18-14(17)12-3-4-13(16-9-12)19-10-11-5-7-15-8-6-11/h3-4,9,11,15H,2,5-8,10H2,1H3
InChIKeyLTRRBEUMKUHMGX-UHFFFAOYSA-N
XLogP1.64
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 6-(piperidin-4-ylamino)pyridine-3-carboxylate
CID 22566555
ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
CID 62348531
5-chloro-2-(piperidin-4-ylmethoxy)pyridine
CID 62348953
6-(cyclopropylmethoxy)pyridine-3-carbonyl chloride
CID 118481303
ethyl 6-(2,2-difluoroethoxy)pyridine-3-carboxylate
CID 103866910
ethyl 6-(2-methylcyclohexyl)oxypyridine-3-carboxylate
CID 114074875
6-(cyclopentylmethoxy)pyridine-3-carboxylic acid
CID 66324302
ethyl 6-methanethioyloxypyridine-3-carboxylate
CID 87198235
ethyl 6-(4-fluorophenoxy)pyridine-3-carboxylate
CID 23149051
N,N-dimethyl-6-(oxan-4-ylmethoxy)pyridine-3-carboxamide
CID 91815390
ethyl 4-(piperidin-3-ylmethoxy)benzoate
CID 24902373
ethyl 6-[3-(hydroxymethyl)pyrrolidin-1-yl]pyridine-3-carboxylate
CID 62371889

Frequently Asked Questions

What is the IUPAC name of ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
The IUPAC name of ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate (CID 62348809) is ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate.
What is the SMILES notation for ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
The canonical SMILES for ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate is CCOC(=O)c1ccc(OCC2CCNCC2)nc1.
What is the InChIKey of ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
The InChIKey is LTRRBEUMKUHMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-18-14(17)12-3-4-13(16-9-12)19-10-11-5-7-15-8-6-11/h3-4,9,11,15H,2,5-8,10H2,1H3.
What are the key properties of ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate has a molecular weight of 264.32 g/mol, XLogP of 1.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate is sourced from PubChem (CID 62348809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).