1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone

C20H24N2O2 — CID 45214839

IUPAC1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone
SMILESO=C(Cc1cccnc1)N1CCOC(CCCc2ccccc2)C1
InChIInChI=1S/C20H24N2O2/c23-20(14-18-9-5-11-21-15-18)22-12-13-24-19(16-22)10-4-8-17-6-2-1-3-7-17/h1-3,5-7,9,11,15,19H,4,8,10,12-14,16H2
InChIKeyQLIBIANXLVKDEF-UHFFFAOYSA-N
MW324.42 g/mol
LogP2.87
Rot. Bonds6

About 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone

1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone (PubChem CID 45214839) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone.

Molecular Properties

Compound Name1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone
PubChem CID45214839
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone
SMILESO=C(Cc1cccnc1)N1CCOC(CCCc2ccccc2)C1
InChIInChI=1S/C20H24N2O2/c23-20(14-18-9-5-11-21-15-18)22-12-13-24-19(16-22)10-4-8-17-6-2-1-3-7-17/h1-3,5-7,9,11,15,19H,4,8,10,12-14,16H2
InChIKeyQLIBIANXLVKDEF-UHFFFAOYSA-N
XLogP2.87
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(hydroxymethyl)morpholin-4-yl]-2-pyridin-3-ylethanone
CID 81208117
[(2R)-2-(3-phenylpropyl)morpholin-4-yl]-pyridin-3-ylmethanone
CID 42377336
1-[(2R)-2-(3-phenylpropyl)morpholin-4-yl]-3-pyridin-4-ylpropan-1-one
CID 42241699
[(2S)-2-(3-phenylpropyl)morpholin-4-yl]-(2-pyridin-4-ylpyrimidin-5-yl)methanone
CID 95553259
1-[(2S)-2-(3-phenylpropyl)morpholin-4-yl]-2-(1,2,4-triazol-1-yl)ethanone
CID 42395968
3-(1-methylpyrazol-4-yl)-1-[(2R)-2-(3-phenylpropyl)morpholin-4-yl]propan-1-one
CID 26317752
oxan-4-yl-[(2S)-2-(3-phenylpropyl)morpholin-4-yl]methanone
CID 25292301
methyl 4-oxo-4-[(2S)-2-(3-phenylpropyl)morpholin-4-yl]butanoate
CID 25379116
[(2S)-2-(2-phenylethyl)morpholin-4-yl]-pyrazin-2-ylmethanone
CID 95969181
3-(1,2-oxazolidin-2-yl)-1-[(2R)-2-(3-phenylpropyl)morpholin-4-yl]propan-1-one
CID 42147501
2-[2-oxo-2-[2-(2-phenylethyl)morpholin-4-yl]ethyl]benzoic acid
CID 120550218
1-[2-(chloromethyl)morpholin-4-yl]-4-phenylbutan-1-one
CID 81210940

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone?
The IUPAC name of 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone (CID 45214839) is 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone.
What is the SMILES notation for 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone?
The canonical SMILES for 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone is O=C(Cc1cccnc1)N1CCOC(CCCc2ccccc2)C1.
What is the InChIKey of 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone?
The InChIKey is QLIBIANXLVKDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c23-20(14-18-9-5-11-21-15-18)22-12-13-24-19(16-22)10-4-8-17-6-2-1-3-7-17/h1-3,5-7,9,11,15,19H,4,8,10,12-14,16H2.
What are the key properties of 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone?
1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone has a molecular weight of 324.42 g/mol, XLogP of 2.87, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-phenylpropyl)morpholin-4-yl]-2-pyridin-3-ylethanone is sourced from PubChem (CID 45214839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).