1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one

C17H22N2O2 — CID 43733396

IUPAC1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one
SMILESCOCCn1cc(NCCCc2ccccc2)ccc1=O
InChIInChI=1S/C17H22N2O2/c1-21-13-12-19-14-16(9-10-17(19)20)18-11-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-10,14,18H,5,8,11-13H2,1H3
InChIKeyKPGWOHTUFJULFW-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.54
Rot. Bonds8

About 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one

1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one (PubChem CID 43733396) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one.

Molecular Properties

Compound Name1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one
PubChem CID43733396
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one
SMILESCOCCn1cc(NCCCc2ccccc2)ccc1=O
InChIInChI=1S/C17H22N2O2/c1-21-13-12-19-14-16(9-10-17(19)20)18-11-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-10,14,18H,5,8,11-13H2,1H3
InChIKeyKPGWOHTUFJULFW-UHFFFAOYSA-N
XLogP2.54
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-(benzylamino)-1-(2-methoxyethyl)pyridin-2-one
CID 43733472
2-fluoro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]benzamide
CID 38675455
1-(2-methoxyethyl)-5-[(1-methylpiperidin-4-yl)methylamino]pyridin-2-one
CID 62657522
1-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-3-[2-(4-methoxyphenyl)ethyl]urea
CID 71940975
1-(2-methoxyethyl)-5-[(5-methylfuran-2-yl)methylamino]pyridin-2-one
CID 43733450
1-(2-methoxyethyl)-6-oxo-N-[2-(4-phenylmethoxyphenyl)ethyl]pyridine-3-carboxamide
CID 47062505
2-(2-methoxyethylamino)-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]acetamide
CID 79281498
2-[[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]sulfamoyl]acetic acid
CID 43716376
5-[(4-bromo-2-fluorophenyl)methylamino]-1-(2-methoxyethyl)pyridin-2-one
CID 43733478
5-[(4-bromothiophen-2-yl)methylamino]-1-(2-methoxyethyl)pyridin-2-one
CID 43733538
1-(2-methoxyethyl)-5-(1,3-thiazol-2-ylmethylamino)pyridin-2-one
CID 63655201
1-bromo-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]methanesulfonamide
CID 83085235

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one?
The IUPAC name of 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one (CID 43733396) is 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one.
What is the SMILES notation for 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one?
The canonical SMILES for 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one is COCCn1cc(NCCCc2ccccc2)ccc1=O.
What is the InChIKey of 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one?
The InChIKey is KPGWOHTUFJULFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-21-13-12-19-14-16(9-10-17(19)20)18-11-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-10,14,18H,5,8,11-13H2,1H3.
What are the key properties of 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one?
1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one has a molecular weight of 286.38 g/mol, XLogP of 2.54, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-5-(3-phenylpropylamino)pyridin-2-one is sourced from PubChem (CID 43733396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).