(3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone

Name: (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₃H₁₇NO₂ — CID 95442884

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC(3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone

SMILESCOc1cccc(C(=O)[C@H]2CCCCN2)c1

InChIInChI=1S/C13H17NO2/c1-16-11-6-4-5-10(9-11)13(15)12-7-2-3-8-14-12/h4-6,9,12,14H,2-3,7-8H2,1H3/t12-/m1/s1

InChIKeyHWMBGNZYSJIYGT-GFCCVEGCSA-N

MW219.28 g/mol

LogP2.02

Rot. Bonds3

About (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone

(3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone (PubChem CID 95442884) has the molecular formula C₁₃H₁₇NO₂ and a molecular weight of 219.28 g/mol. Its IUPAC name is (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone.

Molecular Properties

Compound Name	(3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone
PubChem CID	95442884
Molecular Formula	C₁₃H₁₇NO₂
Molecular Weight	219.28 g/mol
Exact Mass	219.13
IUPAC Name	(3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone
SMILES	COc1cccc(C(=O)[C@H]2CCCCN2)c1
InChI	InChI=1S/C13H17NO2/c1-16-11-6-4-5-10(9-11)13(15)12-7-2-3-8-14-12/h4-6,9,12,14H,2-3,7-8H2,1H3/t12-/m1/s1
InChIKey	HWMBGNZYSJIYGT-GFCCVEGCSA-N
XLogP	2.02
TPSA	38.33 Å²
H-Bond Donors	1
H-Bond Acceptors	3
Rotatable Bonds	3
Heavy Atoms	16
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	219.28
LogP ≤ 5	2.02
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone?

The IUPAC name of (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone (CID 95442884) is (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone.

What is the SMILES notation for (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone?

The canonical SMILES for (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone is COc1cccc(C(=O)[C@H]2CCCCN2)c1.

What is the InChIKey of (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone?

The InChIKey is HWMBGNZYSJIYGT-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H17NO2/c1-16-11-6-4-5-10(9-11)13(15)12-7-2-3-8-14-12/h4-6,9,12,14H,2-3,7-8H2,1H3/t12-/m1/s1.

What are the key properties of (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone?

(3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone has a molecular weight of 219.28 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for (3-methoxyphenyl)-[(2R)-piperidin-2-yl]methanone is sourced from PubChem (CID 95442884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 95442884 — identifiers, structure, computed properties (public domain)

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