4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine

C17H26ClN3O2 — CID 75442498

IUPAC4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine
SMILESCC(CN1CCOCC1)N1CCCC(Oc2ccc(Cl)cn2)C1
InChIInChI=1S/C17H26ClN3O2/c1-14(12-20-7-9-22-10-8-20)21-6-2-3-16(13-21)23-17-5-4-15(18)11-19-17/h4-5,11,14,16H,2-3,6-10,12-13H2,1H3
InChIKeyQEFSALNBFGVPOW-UHFFFAOYSA-N
MW339.87 g/mol
LogP2.30
Rot. Bonds5

About 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine

4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine (PubChem CID 75442498) has the molecular formula C17H26ClN3O2 and a molecular weight of 339.87 g/mol. Its IUPAC name is 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine.

Molecular Properties

Compound Name4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine
PubChem CID75442498
Molecular FormulaC17H26ClN3O2
Molecular Weight339.87 g/mol
Exact Mass339.17
IUPAC Name4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine
SMILESCC(CN1CCOCC1)N1CCCC(Oc2ccc(Cl)cn2)C1
InChIInChI=1S/C17H26ClN3O2/c1-14(12-20-7-9-22-10-8-20)21-6-2-3-16(13-21)23-17-5-4-15(18)11-19-17/h4-5,11,14,16H,2-3,6-10,12-13H2,1H3
InChIKeyQEFSALNBFGVPOW-UHFFFAOYSA-N
XLogP2.30
TPSA37.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.87
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine?
The IUPAC name of 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine (CID 75442498) is 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine.
What is the SMILES notation for 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine?
The canonical SMILES for 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine is CC(CN1CCOCC1)N1CCCC(Oc2ccc(Cl)cn2)C1.
What is the InChIKey of 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine?
The InChIKey is QEFSALNBFGVPOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClN3O2/c1-14(12-20-7-9-22-10-8-20)21-6-2-3-16(13-21)23-17-5-4-15(18)11-19-17/h4-5,11,14,16H,2-3,6-10,12-13H2,1H3.
What are the key properties of 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine?
4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine has a molecular weight of 339.87 g/mol, XLogP of 2.30, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[3-[(5-chloro-2-pyridinyl)oxy]piperidin-1-yl]propyl]morpholine is sourced from PubChem (CID 75442498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).