5-methoxy-1-piperidin-4-yl-3H-indol-2-one

C14H18N2O2 — CID 84632312

IUPAC5-methoxy-1-piperidin-4-yl-3H-indol-2-one
SMILESCOc1ccc2c(c1)CC(=O)N2C1CCNCC1
InChIInChI=1S/C14H18N2O2/c1-18-12-2-3-13-10(8-12)9-14(17)16(13)11-4-6-15-7-5-11/h2-3,8,11,15H,4-7,9H2,1H3
InChIKeyQNQMXDQWJFMUEU-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.34
Rot. Bonds2

About 5-methoxy-1-piperidin-4-yl-3H-indol-2-one

5-methoxy-1-piperidin-4-yl-3H-indol-2-one (PubChem CID 84632312) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-methoxy-1-piperidin-4-yl-3H-indol-2-one.

Molecular Properties

Compound Name5-methoxy-1-piperidin-4-yl-3H-indol-2-one
PubChem CID84632312
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name5-methoxy-1-piperidin-4-yl-3H-indol-2-one
SMILESCOc1ccc2c(c1)CC(=O)N2C1CCNCC1
InChIInChI=1S/C14H18N2O2/c1-18-12-2-3-13-10(8-12)9-14(17)16(13)11-4-6-15-7-5-11/h2-3,8,11,15H,4-7,9H2,1H3
InChIKeyQNQMXDQWJFMUEU-UHFFFAOYSA-N
XLogP1.34
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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5-(2-aminoethyl)-1-pyrrolidin-3-yl-3H-indol-2-one
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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-piperidin-4-yl-3H-indol-2-one?
The IUPAC name of 5-methoxy-1-piperidin-4-yl-3H-indol-2-one (CID 84632312) is 5-methoxy-1-piperidin-4-yl-3H-indol-2-one.
What is the SMILES notation for 5-methoxy-1-piperidin-4-yl-3H-indol-2-one?
The canonical SMILES for 5-methoxy-1-piperidin-4-yl-3H-indol-2-one is COc1ccc2c(c1)CC(=O)N2C1CCNCC1.
What is the InChIKey of 5-methoxy-1-piperidin-4-yl-3H-indol-2-one?
The InChIKey is QNQMXDQWJFMUEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-18-12-2-3-13-10(8-12)9-14(17)16(13)11-4-6-15-7-5-11/h2-3,8,11,15H,4-7,9H2,1H3.
What are the key properties of 5-methoxy-1-piperidin-4-yl-3H-indol-2-one?
5-methoxy-1-piperidin-4-yl-3H-indol-2-one has a molecular weight of 246.31 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-piperidin-4-yl-3H-indol-2-one is sourced from PubChem (CID 84632312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).