4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine

C15H21NO2 — CID 178102409

IUPAC4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine
SMILESCOc1ccc2c(c1)C(C1CCN(C)CC1)CO2
InChIInChI=1S/C15H21NO2/c1-16-7-5-11(6-8-16)14-10-18-15-4-3-12(17-2)9-13(14)15/h3-4,9,11,14H,5-8,10H2,1-2H3
InChIKeyRFAXHKLVISFZIO-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.51
Rot. Bonds2

About 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine

4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine (PubChem CID 178102409) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine.

Molecular Properties

Compound Name4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine
PubChem CID178102409
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine
SMILESCOc1ccc2c(c1)C(C1CCN(C)CC1)CO2
InChIInChI=1S/C15H21NO2/c1-16-7-5-11(6-8-16)14-10-18-15-4-3-12(17-2)9-13(14)15/h3-4,9,11,14H,5-8,10H2,1-2H3
InChIKeyRFAXHKLVISFZIO-UHFFFAOYSA-N
XLogP2.51
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpyrrolidine
CID 178102600
N-(6-methoxy-3,4-dihydro-2H-chromen-4-yl)-1-methylpiperidin-4-amine
CID 43775844
2-[(3aR,9bR)-8-methoxy-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrol-2-yl]ethanamine
CID 21309100
(4aR,10bS)-9-methoxy-4-propyl-1,2,3,4a,5,10b-hexahydrochromeno[3,4-b]pyridine
CID 18603956
5-methoxy-3-methyl-2,3-dihydro-1-benzofuran
CID 102492939
(3R)-3-(difluoromethyl)-5-methoxy-2,3-dihydro-1-benzofuran
CID 125488470
O-[(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)methyl]hydroxylamine
CID 117202333
2-[(3S)-5-methoxy-2,3-dihydro-1-benzofuran-3-yl]acetic acid
CID 129361652
5-methoxy-3-(2,2,2-trifluoroethyl)-2,3-dihydro-1-benzofuran
CID 134850979
9-methoxy-2,3,4,4a,5,10b-hexahydro-1H-chromeno[4,3-b]pyridine
CID 83888852
6-methoxy-4-propan-2-yl-3,4-dihydro-2H-chromene
CID 155736305
1-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)propan-2-one
CID 117202321

Frequently Asked Questions

What is the IUPAC name of 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine?
The IUPAC name of 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine (CID 178102409) is 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine.
What is the SMILES notation for 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine?
The canonical SMILES for 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine is COc1ccc2c(c1)C(C1CCN(C)CC1)CO2.
What is the InChIKey of 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine?
The InChIKey is RFAXHKLVISFZIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-16-7-5-11(6-8-16)14-10-18-15-4-3-12(17-2)9-13(14)15/h3-4,9,11,14H,5-8,10H2,1-2H3.
What are the key properties of 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine?
4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine has a molecular weight of 247.34 g/mol, XLogP of 2.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methoxy-2,3-dihydro-1-benzofuran-3-yl)-1-methylpiperidine is sourced from PubChem (CID 178102409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).