2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine

C14H19NO3 — CID 117376371

IUPAC2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine
SMILESCOc1cc2c(c(C3CCCCN3)c1)OCCO2
InChIInChI=1S/C14H19NO3/c1-16-10-8-11(12-4-2-3-5-15-12)14-13(9-10)17-6-7-18-14/h8-9,12,15H,2-7H2,1H3
InChIKeyLLJPIOFKMUZHCT-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.28
Rot. Bonds2

About 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine

2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine (PubChem CID 117376371) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine.

Molecular Properties

Compound Name2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine
PubChem CID117376371
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC Name2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine
SMILESCOc1cc2c(c(C3CCCCN3)c1)OCCO2
InChIInChI=1S/C14H19NO3/c1-16-10-8-11(12-4-2-3-5-15-12)14-13(9-10)17-6-7-18-14/h8-9,12,15H,2-7H2,1H3
InChIKeyLLJPIOFKMUZHCT-UHFFFAOYSA-N
XLogP2.28
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(6-chloro-5-methyl-2,3-dihydro-1,4-benzodioxin-7-yl)piperidine
CID 117423106
2-[7-(2-fluoropropan-2-yl)-2,3-dihydro-1,4-benzodioxin-5-yl]pyrrolidine
CID 117417339
5-fluoro-7-piperidin-2-yl-2,3-dihydro-1,4-benzodioxin-6-ol
CID 117385564
4-methoxy-2-[(2S)-piperidin-2-yl]phenol
CID 131531573
4-methoxy-2-[(2R)-piperidin-2-yl]phenol
CID 131513044
2-(7-ethyl-2,3-dihydro-1,4-benzodioxin-6-yl)piperidine
CID 117371289
2-(7-fluoro-6-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine
CID 117385693
2-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)piperidine
CID 117387275
(2R)-2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidine
CID 51716217
4-(6-methoxy-1,3-benzodioxol-4-yl)piperidine
CID 117342505
2-(2-bromo-5-methoxyphenyl)azepane
CID 62543075
2-(6-ethyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)piperidine
CID 117408174

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine?
The IUPAC name of 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine (CID 117376371) is 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine.
What is the SMILES notation for 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine?
The canonical SMILES for 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine is COc1cc2c(c(C3CCCCN3)c1)OCCO2.
What is the InChIKey of 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine?
The InChIKey is LLJPIOFKMUZHCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-16-10-8-11(12-4-2-3-5-15-12)14-13(9-10)17-6-7-18-14/h8-9,12,15H,2-7H2,1H3.
What are the key properties of 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine?
2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine has a molecular weight of 249.31 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-2,3-dihydro-1,4-benzodioxin-5-yl)piperidine is sourced from PubChem (CID 117376371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).