4-(1-benzofuran-3-yl)-1-methylpiperidine

C14H17NO — CID 20758862

IUPAC4-(1-benzofuran-3-yl)-1-methylpiperidine
SMILESCN1CCC(c2coc3ccccc23)CC1
InChIInChI=1S/C14H17NO/c1-15-8-6-11(7-9-15)13-10-16-14-5-3-2-4-12(13)14/h2-5,10-11H,6-9H2,1H3
InChIKeyNYLCVUAQMLJSGP-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.24
Rot. Bonds1

About 4-(1-benzofuran-3-yl)-1-methylpiperidine

4-(1-benzofuran-3-yl)-1-methylpiperidine (PubChem CID 20758862) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 4-(1-benzofuran-3-yl)-1-methylpiperidine.

Molecular Properties

Compound Name4-(1-benzofuran-3-yl)-1-methylpiperidine
PubChem CID20758862
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name4-(1-benzofuran-3-yl)-1-methylpiperidine
SMILESCN1CCC(c2coc3ccccc23)CC1
InChIInChI=1S/C14H17NO/c1-15-8-6-11(7-9-15)13-10-16-14-5-3-2-4-12(13)14/h2-5,10-11H,6-9H2,1H3
InChIKeyNYLCVUAQMLJSGP-UHFFFAOYSA-N
XLogP3.24
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1-benzofuran-3-yl)-1-methylpiperidine?
The IUPAC name of 4-(1-benzofuran-3-yl)-1-methylpiperidine (CID 20758862) is 4-(1-benzofuran-3-yl)-1-methylpiperidine.
What is the SMILES notation for 4-(1-benzofuran-3-yl)-1-methylpiperidine?
The canonical SMILES for 4-(1-benzofuran-3-yl)-1-methylpiperidine is CN1CCC(c2coc3ccccc23)CC1.
What is the InChIKey of 4-(1-benzofuran-3-yl)-1-methylpiperidine?
The InChIKey is NYLCVUAQMLJSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-15-8-6-11(7-9-15)13-10-16-14-5-3-2-4-12(13)14/h2-5,10-11H,6-9H2,1H3.
What are the key properties of 4-(1-benzofuran-3-yl)-1-methylpiperidine?
4-(1-benzofuran-3-yl)-1-methylpiperidine has a molecular weight of 215.30 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzofuran-3-yl)-1-methylpiperidine is sourced from PubChem (CID 20758862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).