1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine

C12H22N2O — CID 114410478

IUPAC1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine
SMILESC1=CCN(CCOC2CCNCC2)CC1
InChIInChI=1S/C12H22N2O/c1-2-8-14(9-3-1)10-11-15-12-4-6-13-7-5-12/h1-2,12-13H,3-11H2
InChIKeyVUYCFKFFKPTYPC-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.02
Rot. Bonds4

About 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine

1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine (PubChem CID 114410478) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine
PubChem CID114410478
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine
SMILESC1=CCN(CCOC2CCNCC2)CC1
InChIInChI=1S/C12H22N2O/c1-2-8-14(9-3-1)10-11-15-12-4-6-13-7-5-12/h1-2,12-13H,3-11H2
InChIKeyVUYCFKFFKPTYPC-UHFFFAOYSA-N
XLogP1.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-[2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine
CID 113591697
1-(2-piperidin-4-yloxyethyl)-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine
CID 114490187
2-[(5-fluoro-3,6-dihydro-2H-pyridin-1-yl)methyl]morpholine
CID 130949222
N-(2-morpholin-2-ylethyl)-N-prop-2-enylprop-2-en-1-amine
CID 66428345
2-Hept-2-enylmorpholine
CID 68588235
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]cyclohex-2-en-1-amine
CID 70892510
(1R)-4-(2,6-dimethylmorpholin-4-yl)cyclohex-2-en-1-amine
CID 70974391
4-(2,6-Dimethylmorpholin-4-yl)cyclohex-2-en-1-amine
CID 71080599
4-[2-(1,2,3,6-Tetrahydropyridin-4-yl)ethyl]morpholine
CID 107489754
4-(2-Piperidin-4-ylideneethyl)morpholine
CID 115020790
4-(1-Methylpiperidin-4-yl)oxy-1,2,3,6-tetrahydropyridin-3-amine
CID 123798637
4-Morpholin-4-ylcyclohex-2-en-1-amine
CID 126490186

Frequently Asked Questions

What is the IUPAC name of 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
The IUPAC name of 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine (CID 114410478) is 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
The canonical SMILES for 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine is C1=CCN(CCOC2CCNCC2)CC1.
What is the InChIKey of 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
The InChIKey is VUYCFKFFKPTYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-2-8-14(9-3-1)10-11-15-12-4-6-13-7-5-12/h1-2,12-13H,3-11H2.
What are the key properties of 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine has a molecular weight of 210.32 g/mol, XLogP of 1.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 114410478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).