4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine

C15H20N2O — CID 146420453

IUPAC4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine
SMILESC1=C(OC2CNC2)CCN(Cc2ccccc2)C1
InChIInChI=1S/C15H20N2O/c1-2-4-13(5-3-1)12-17-8-6-14(7-9-17)18-15-10-16-11-15/h1-6,15-16H,7-12H2
InChIKeyLYAASBUHJVOACN-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.76
Rot. Bonds4

About 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine

4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine (PubChem CID 146420453) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine
PubChem CID146420453
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine
SMILESC1=C(OC2CNC2)CCN(Cc2ccccc2)C1
InChIInChI=1S/C15H20N2O/c1-2-4-13(5-3-1)12-17-8-6-14(7-9-17)18-15-10-16-11-15/h1-6,15-16H,7-12H2
InChIKeyLYAASBUHJVOACN-UHFFFAOYSA-N
XLogP1.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-4-cyclopropyloxy-3,6-dihydro-2H-pyridine
CID 178156806
1-benzyl-4-(3-methylcyclobutyl)oxy-3,6-dihydro-2H-pyridine
CID 159320689
[3-[(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)oxy]cyclobutyl]methanol
CID 139530799
1-benzyl-4-(1-methylpiperidin-3-yl)oxy-3,6-dihydro-2H-pyridine
CID 70920175
1-benzyl-4-(1-benzyl-1-methylpyrrolidin-1-ium-3-yl)oxy-3,6-dihydro-2H-pyridine
CID 58393111
1-benzyl-4-methoxy-3,6-dihydro-2H-pyridine;cyclobutylmethanol
CID 156719785
(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)methanamine
CID 10330491
ethyl 1-benzyl-3,6-dihydro-2H-pyridine-4-carboxylate
CID 787906
1-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)-5-methylpyrrolidin-2-one
CID 126526003
4-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)aniline
CID 22499416
1-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)ethanol
CID 19900296
1-benzyl-4-(2-phenylethynyl)-3,6-dihydro-2H-pyridine
CID 11821785

Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine (CID 146420453) is 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine is C1=C(OC2CNC2)CCN(Cc2ccccc2)C1.
What is the InChIKey of 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine?
The InChIKey is LYAASBUHJVOACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-2-4-13(5-3-1)12-17-8-6-14(7-9-17)18-15-10-16-11-15/h1-6,15-16H,7-12H2.
What are the key properties of 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine?
4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine has a molecular weight of 244.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-3-yloxy)-1-benzyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 146420453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).