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

C14H20N2O3 — CID 62349275

IUPACethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate
SMILESCCOC(=O)c1cccnc1OCC1CCCCN1
InChIInChI=1S/C14H20N2O3/c1-2-18-14(17)12-7-5-9-16-13(12)19-10-11-6-3-4-8-15-11/h5,7,9,11,15H,2-4,6,8,10H2,1H3
InChIKeyPCQDSMVDPCCGHB-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.78
Rot. Bonds5

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

ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate (PubChem CID 62349275) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate.

Molecular Properties

Compound Nameethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate
PubChem CID62349275
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Nameethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate
SMILESCCOC(=O)c1cccnc1OCC1CCCCN1
InChIInChI=1S/C14H20N2O3/c1-2-18-14(17)12-7-5-9-16-13(12)19-10-11-6-3-4-8-15-11/h5,7,9,11,15H,2-4,6,8,10H2,1H3
InChIKeyPCQDSMVDPCCGHB-UHFFFAOYSA-N
XLogP1.78
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 ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(pyrrolidin-2-ylmethoxy)pyridine-3-carboxylate
CID 62347787
propan-2-yl 2-[[(2S)-pyrrolidin-2-yl]methoxy]pyridine-3-carboxylate
CID 67322223
ethyl 2-(piperidin-4-ylmethoxy)pyridine-3-carboxylate
CID 62348531
2-(piperidin-2-ylmethoxy)pyridin-3-ol;hydrochloride
CID 71646420
2-(2-piperidin-2-ylethoxy)pyridine-3-carboxamide
CID 62347441
ethyl 2-[2-[(2R)-piperidin-2-yl]ethoxy]benzoate
CID 86320486
2-(pyrrolidin-2-ylmethoxy)pyridin-3-amine
CID 117096153
ethyl 2-(azetidin-3-yloxy)pyridine-3-carboxylate
CID 63105364
3-chloro-2-[[(2R)-pyrrolidin-2-yl]methoxy]pyridine
CID 94406451
2-(piperidin-3-ylmethoxy)pyridine-3-carboxamide
CID 55065117
2-methoxy-3-(pyrrolidin-2-ylmethoxy)pyridine
CID 122208651
2-methoxy-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 55126271

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate?
The IUPAC name of ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate (CID 62349275) is ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate.
What is the SMILES notation for ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate?
The canonical SMILES for ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate is CCOC(=O)c1cccnc1OCC1CCCCN1.
What is the InChIKey of ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate?
The InChIKey is PCQDSMVDPCCGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-2-18-14(17)12-7-5-9-16-13(12)19-10-11-6-3-4-8-15-11/h5,7,9,11,15H,2-4,6,8,10H2,1H3.
What are the key properties of ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate?
ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate has a molecular weight of 264.32 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(piperidin-2-ylmethoxy)pyridine-3-carboxylate is sourced from PubChem (CID 62349275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).