3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one

C16H18N2O3 — CID 71989321

IUPAC3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCC1CCN(C(=O)c2ccc[nH]c2=O)C(c2ccco2)C1
InChIInChI=1S/C16H18N2O3/c1-11-6-8-18(13(10-11)14-5-3-9-21-14)16(20)12-4-2-7-17-15(12)19/h2-5,7,9,11,13H,6,8,10H2,1H3,(H,17,19)
InChIKeyFUJQMZBGKSJRQP-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.58
Rot. Bonds2

About 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one

3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 71989321) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID71989321
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one
SMILESCC1CCN(C(=O)c2ccc[nH]c2=O)C(c2ccco2)C1
InChIInChI=1S/C16H18N2O3/c1-11-6-8-18(13(10-11)14-5-3-9-21-14)16(20)12-4-2-7-17-15(12)19/h2-5,7,9,11,13H,6,8,10H2,1H3,(H,17,19)
InChIKeyFUJQMZBGKSJRQP-UHFFFAOYSA-N
XLogP2.58
TPSA66.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one (CID 71989321) is 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one is CC1CCN(C(=O)c2ccc[nH]c2=O)C(c2ccco2)C1.
What is the InChIKey of 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is FUJQMZBGKSJRQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-6-8-18(13(10-11)14-5-3-9-21-14)16(20)12-4-2-7-17-15(12)19/h2-5,7,9,11,13H,6,8,10H2,1H3,(H,17,19).
What are the key properties of 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one?
3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 286.33 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(furan-2-yl)-4-methylpiperidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 71989321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).