4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one

C24H27N3O3 — CID 58964959

IUPAC4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1-c1ccc(OCCN2CCCCC2)nc1
InChIInChI=1S/C24H27N3O3/c28-24-17-22(30-19-20-7-3-1-4-8-20)11-14-27(24)21-9-10-23(25-18-21)29-16-15-26-12-5-2-6-13-26/h1,3-4,7-11,14,17-18H,2,5-6,12-13,15-16,19H2
InChIKeyWWLLCTIQCGSIGP-UHFFFAOYSA-N
MW405.50 g/mol
LogP3.68
Rot. Bonds8

About 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one

4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one (PubChem CID 58964959) has the molecular formula C24H27N3O3 and a molecular weight of 405.50 g/mol. Its IUPAC name is 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one.

Molecular Properties

Compound Name4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one
PubChem CID58964959
Molecular FormulaC24H27N3O3
Molecular Weight405.50 g/mol
Exact Mass405.21
IUPAC Name4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1-c1ccc(OCCN2CCCCC2)nc1
InChIInChI=1S/C24H27N3O3/c28-24-17-22(30-19-20-7-3-1-4-8-20)11-14-27(24)21-9-10-23(25-18-21)29-16-15-26-12-5-2-6-13-26/h1,3-4,7-11,14,17-18H,2,5-6,12-13,15-16,19H2
InChIKeyWWLLCTIQCGSIGP-UHFFFAOYSA-N
XLogP3.68
TPSA56.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.50
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one?
The IUPAC name of 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one (CID 58964959) is 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one.
What is the SMILES notation for 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one?
The canonical SMILES for 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one is O=c1cc(OCc2ccccc2)ccn1-c1ccc(OCCN2CCCCC2)nc1.
What is the InChIKey of 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one?
The InChIKey is WWLLCTIQCGSIGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3/c28-24-17-22(30-19-20-7-3-1-4-8-20)11-14-27(24)21-9-10-23(25-18-21)29-16-15-26-12-5-2-6-13-26/h1,3-4,7-11,14,17-18H,2,5-6,12-13,15-16,19H2.
What are the key properties of 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one?
4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one has a molecular weight of 405.50 g/mol, XLogP of 3.68, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxy-1-[6-(2-piperidin-1-ylethoxy)-3-pyridinyl]pyridin-2-one is sourced from PubChem (CID 58964959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).