1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one

C15H21NO2 — CID 43227136

IUPAC1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one
SMILESCOc1ccc(C(=O)C(C)N2CCCCC2)cc1
InChIInChI=1S/C15H21NO2/c1-12(16-10-4-3-5-11-16)15(17)13-6-8-14(18-2)9-7-13/h6-9,12H,3-5,10-11H2,1-2H3
InChIKeyPBMAYNBJTYBUFZ-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.75
Rot. Bonds4

About 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one

1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one (PubChem CID 43227136) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one
PubChem CID43227136
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one
SMILESCOc1ccc(C(=O)C(C)N2CCCCC2)cc1
InChIInChI=1S/C15H21NO2/c1-12(16-10-4-3-5-11-16)15(17)13-6-8-14(18-2)9-7-13/h6-9,12H,3-5,10-11H2,1-2H3
InChIKeyPBMAYNBJTYBUFZ-UHFFFAOYSA-N
XLogP2.75
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one 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-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)propan-1-one
CID 43227288
2-(4,4-dimethylazepan-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 65282810
2-(4,4-dimethylpiperidin-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 62931770
2-(4-hydroxypiperidin-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 60680419
2-(4-aminopiperidin-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 62029201
1-(4-methoxyphenyl)-2-(3-methoxypiperidin-1-yl)propan-1-one
CID 102960681
2-(4-ethyl-4-methylpiperidin-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 63158465
2-[4-(hydroxymethyl)piperidin-1-yl]-1-(4-methoxyphenyl)propan-1-one
CID 62024780
1-naphthalen-2-yl-2-piperidin-1-ylpropan-1-one;hydrochloride
CID 2845131
2-(azocan-1-yl)-1-(4-ethylphenyl)propan-1-one
CID 43228442
2-(3-aminopyrrolidin-1-yl)-1-(4-methoxyphenyl)propan-1-one
CID 62068455
2-[3-(2-hydroxyethyl)piperidin-1-yl]-1-(4-methoxyphenyl)propan-1-one
CID 107228031

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one?
The IUPAC name of 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one (CID 43227136) is 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one?
The canonical SMILES for 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one is COc1ccc(C(=O)C(C)N2CCCCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one?
The InChIKey is PBMAYNBJTYBUFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-12(16-10-4-3-5-11-16)15(17)13-6-8-14(18-2)9-7-13/h6-9,12H,3-5,10-11H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one?
1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one has a molecular weight of 247.34 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 43227136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).