2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine

C13H24N2O2 — CID 114411038

IUPAC2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine
SMILESCOCC1=CCN(CCC2CNCCO2)CC1
InChIInChI=1S/C13H24N2O2/c1-16-11-12-2-6-15(7-3-12)8-4-13-10-14-5-9-17-13/h2,13-14H,3-11H2,1H3
InChIKeyOQHGRXUBXZLEFZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.64
Rot. Bonds5

About 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine

2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine (PubChem CID 114411038) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine.

Molecular Properties

Compound Name2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine
PubChem CID114411038
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine
SMILESCOCC1=CCN(CCC2CNCCO2)CC1
InChIInChI=1S/C13H24N2O2/c1-16-11-12-2-6-15(7-3-12)8-4-13-10-14-5-9-17-13/h2,13-14H,3-11H2,1H3
InChIKeyOQHGRXUBXZLEFZ-UHFFFAOYSA-N
XLogP0.64
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(methoxymethyl)-1-(3-pyrrolidin-3-ylpropyl)-3,6-dihydro-2H-pyridine
CID 114411004
2-[2-(4-methylpiperidin-1-yl)ethyl]morpholine
CID 66428554
N-(cyclopropylmethyl)-2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethanamine
CID 114411060
1-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]hexan-3-amine
CID 114410986
2-[2-(2,2-dimethylpyrrolidin-1-yl)ethyl]morpholine
CID 66426865
(2S)-2-(methoxymethyl)morpholine
CID 10103206
(2S)-2-(methoxymethyl)morpholine;(2R)-2-(methoxymethyl)morpholine
CID 163652511
5-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-N-methylpentan-1-amine
CID 114413427
4-(methoxymethyl)-1-[(3-methylpyrrolidin-2-yl)methyl]-3,6-dihydro-2H-pyridine
CID 102776256
2-[2-(3-ethylpiperidin-1-yl)ethyl]morpholine
CID 66427069
2-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)ethyl]morpholine
CID 66429637
N-[6-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]hexyl]cyclopropanamine
CID 114413385

Frequently Asked Questions

What is the IUPAC name of 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine?
The IUPAC name of 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine (CID 114411038) is 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine.
What is the SMILES notation for 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine?
The canonical SMILES for 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine is COCC1=CCN(CCC2CNCCO2)CC1.
What is the InChIKey of 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine?
The InChIKey is OQHGRXUBXZLEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-16-11-12-2-6-15(7-3-12)8-4-13-10-14-5-9-17-13/h2,13-14H,3-11H2,1H3.
What are the key properties of 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine?
2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine has a molecular weight of 240.35 g/mol, XLogP of 0.64, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine is sourced from PubChem (CID 114411038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).