4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine

C14H26N2O — CID 106741220

IUPAC4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine
SMILESCOCC1=CCN(CC2CCNC(C)C2)CC1
InChIInChI=1S/C14H26N2O/c1-12-9-14(3-6-15-12)10-16-7-4-13(5-8-16)11-17-2/h4,12,14-15H,3,5-11H2,1-2H3
InChIKeyKEUVXZRRKRHFOR-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.65
Rot. Bonds4

About 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine

4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine (PubChem CID 106741220) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine
PubChem CID106741220
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine
SMILESCOCC1=CCN(CC2CCNC(C)C2)CC1
InChIInChI=1S/C14H26N2O/c1-12-9-14(3-6-15-12)10-16-7-4-13(5-8-16)11-17-2/h4,12,14-15H,3,5-11H2,1-2H3
InChIKeyKEUVXZRRKRHFOR-UHFFFAOYSA-N
XLogP1.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.65
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

1-methyl-3-(4-methyl-3,6-dihydro-2H-pyran-3-yl)piperazine
CID 167165127
4-(methoxymethyl)-1-[(3-methylpyrrolidin-2-yl)methyl]-3,6-dihydro-2H-pyridine
CID 102776256
[4-[[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]cyclohexyl]methanamine
CID 104963658
4-(methoxymethyl)-1-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3,6-dihydro-2H-pyridine
CID 108122767
1-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-4,4-dimethylpentan-3-amine
CID 113581621
4-(methoxymethyl)-1-(2-piperidin-4-ylethyl)-3,6-dihydro-2H-pyridine
CID 113581627
6-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]-3,3-dimethylhexan-1-amine
CID 113581630
4-(methoxymethyl)-1-[(4-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine
CID 113581632
4-(methoxymethyl)-1-(3-piperidin-2-ylpropyl)-3,6-dihydro-2H-pyridine
CID 113581634
3-ethyl-6-[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]hexan-1-amine
CID 113581635
2-[[4-(methoxymethyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]-6-azaspiro[2.5]octane
CID 113581642
4-(methoxymethyl)-1-(3-piperidin-4-ylpropyl)-3,6-dihydro-2H-pyridine
CID 113581643

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine (CID 106741220) is 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine is COCC1=CCN(CC2CCNC(C)C2)CC1.
What is the InChIKey of 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine?
The InChIKey is KEUVXZRRKRHFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-12-9-14(3-6-15-12)10-16-7-4-13(5-8-16)11-17-2/h4,12,14-15H,3,5-11H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine?
4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine has a molecular weight of 238.37 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-1-[(2-methylpiperidin-4-yl)methyl]-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 106741220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).