ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate

C14H20N2O3 — CID 62348531

IUPACethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
SMILESCCOC(=O)c1cccnc1OCC1CCNCC1
InChIInChI=1S/C14H20N2O3/c1-2-18-14(17)12-4-3-7-16-13(12)19-10-11-5-8-15-9-6-11/h3-4,7,11,15H,2,5-6,8-10H2,1H3
InChIKeyLKIROOQXFNOIFW-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.64
Rot. Bonds5

About ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate

ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate (PubChem CID 62348531) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
PubChem CID62348531
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Nameethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
SMILESCCOC(=O)c1cccnc1OCC1CCNCC1
InChIInChI=1S/C14H20N2O3/c1-2-18-14(17)12-4-3-7-16-13(12)19-10-11-5-8-15-9-6-11/h3-4,7,11,15H,2,5-6,8-10H2,1H3
InChIKeyLKIROOQXFNOIFW-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 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate
CID 62349275
ethyl 2-(azetidin-3-yloxy)pyridine-3-carboxylate
CID 63105364
2-(piperidin-4-ylmethoxy)pyridin-3-ol
CID 71646429
2-(piperidin-3-ylmethoxy)pyridine-3-carboxamide
CID 55065117
ethyl 2-(pyrrolidin-3-ylmethoxy)benzoate;hydrochloride
CID 56829770
ethyl 6-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
CID 62348809
ethyl 2-(2-piperidin-4-yloxyethylamino)pyridine-3-carboxylate
CID 63870177
3-chloro-2-(piperidin-4-ylmethoxy)pyridine;hydrochloride
CID 162422899
ethyl 3-(cyclopropylmethoxy)pyridine-2-carboxylate
CID 133080995
ethyl 2-(piperidin-3-ylmethoxy)benzoate;hydrochloride
CID 56830906
methyl 2-(pyrrolidin-2-ylmethoxy)pyridine-3-carboxylate
CID 62347787
ethyl 2-[methyl(piperidin-3-ylmethyl)amino]pyridine-3-carboxylate
CID 106642853

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
The IUPAC name of ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate (CID 62348531) is ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
The canonical SMILES for ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate is CCOC(=O)c1cccnc1OCC1CCNCC1.
What is the InChIKey of ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
The InChIKey is LKIROOQXFNOIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-18-14(17)12-4-3-7-16-13(12)19-10-11-5-8-15-9-6-11/h3-4,7,11,15H,2,5-6,8-10H2,1H3.
What are the key properties of ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate?
ethyl 2-(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 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate is sourced from PubChem (CID 62348531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).