ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate

C14H20N2O3 — CID 71799576

IUPACethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(Oc2cccc(C)n2)CC1
InChIInChI=1S/C14H20N2O3/c1-3-18-14(17)16-9-7-12(8-10-16)19-13-6-4-5-11(2)15-13/h4-6,12H,3,7-10H2,1-2H3
InChIKeyDQTLDQNHDZTJST-UHFFFAOYSA-N
MW264.32 g/mol
LogP2.39
Rot. Bonds3

About ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate

ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate (PubChem CID 71799576) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate.

Molecular Properties

Compound Nameethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate
PubChem CID71799576
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Nameethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate
SMILESCCOC(=O)N1CCC(Oc2cccc(C)n2)CC1
InChIInChI=1S/C14H20N2O3/c1-3-18-14(17)16-9-7-12(8-10-16)19-13-6-4-5-11(2)15-13/h4-6,12H,3,7-10H2,1-2H3
InChIKeyDQTLDQNHDZTJST-UHFFFAOYSA-N
XLogP2.39
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate?
The IUPAC name of ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate (CID 71799576) is ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate.
What is the SMILES notation for ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate?
The canonical SMILES for ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate is CCOC(=O)N1CCC(Oc2cccc(C)n2)CC1.
What is the InChIKey of ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate?
The InChIKey is DQTLDQNHDZTJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-18-14(17)16-9-7-12(8-10-16)19-13-6-4-5-11(2)15-13/h4-6,12H,3,7-10H2,1-2H3.
What are the key properties of ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate?
ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate has a molecular weight of 264.32 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-[(6-methyl-2-pyridinyl)oxy]piperidine-1-carboxylate is sourced from PubChem (CID 71799576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).