6-(2-propoxybenzoyl)piperidin-2-one

C15H19NO3 — CID 54196538

IUPAC6-(2-propoxybenzoyl)piperidin-2-one
SMILESCCCOc1ccccc1C(=O)C1CCCC(=O)N1
InChIInChI=1S/C15H19NO3/c1-2-10-19-13-8-4-3-6-11(13)15(18)12-7-5-9-14(17)16-12/h3-4,6,8,12H,2,5,7,9-10H2,1H3,(H,16,17)
InChIKeyPMEZDUUUMGNGEX-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.33
Rot. Bonds5

About 6-(2-propoxybenzoyl)piperidin-2-one

6-(2-propoxybenzoyl)piperidin-2-one (PubChem CID 54196538) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is 6-(2-propoxybenzoyl)piperidin-2-one.

Molecular Properties

Compound Name6-(2-propoxybenzoyl)piperidin-2-one
PubChem CID54196538
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name6-(2-propoxybenzoyl)piperidin-2-one
SMILESCCCOc1ccccc1C(=O)C1CCCC(=O)N1
InChIInChI=1S/C15H19NO3/c1-2-10-19-13-8-4-3-6-11(13)15(18)12-7-5-9-14(17)16-12/h3-4,6,8,12H,2,5,7,9-10H2,1H3,(H,16,17)
InChIKeyPMEZDUUUMGNGEX-UHFFFAOYSA-N
XLogP2.33
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-(2-propoxybenzoyl)piperidin-2-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

6-(2-ethylbenzoyl)piperidin-2-one
CID 54106126
azepan-2-yl-[2-(2-methoxyethoxy)phenyl]methanone
CID 116582652
(2-propoxyphenyl)-thiomorpholin-3-ylmethanone
CID 116609477
(2-propoxyphenyl)-(thiolan-2-yl)methanone
CID 104659403
6-(4-butoxybenzoyl)piperidin-2-one
CID 54128984
2-cyclopropyl-1-(2-propoxyphenyl)ethanone
CID 104659396
(4-propan-2-ylcyclohexyl)-(2-propoxyphenyl)methanone
CID 104659305
2-(cyclopentylamino)-1-(2-propoxyphenyl)ethanone
CID 116558980
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
1-cyclopentyl-6-hydroxy-4-methyl-2-oxo-5-(2-propoxybenzoyl)pyridine-3-carbonitrile
CID 19116226
(1-ethoxycyclopentyl)-(2-propoxyphenyl)methanone
CID 116747778
2-(2-propoxyphenyl)cyclopentane-1-carboxylic acid
CID 104663378

Frequently Asked Questions

What is the IUPAC name of 6-(2-propoxybenzoyl)piperidin-2-one?
The IUPAC name of 6-(2-propoxybenzoyl)piperidin-2-one (CID 54196538) is 6-(2-propoxybenzoyl)piperidin-2-one.
What is the SMILES notation for 6-(2-propoxybenzoyl)piperidin-2-one?
The canonical SMILES for 6-(2-propoxybenzoyl)piperidin-2-one is CCCOc1ccccc1C(=O)C1CCCC(=O)N1.
What is the InChIKey of 6-(2-propoxybenzoyl)piperidin-2-one?
The InChIKey is PMEZDUUUMGNGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-2-10-19-13-8-4-3-6-11(13)15(18)12-7-5-9-14(17)16-12/h3-4,6,8,12H,2,5,7,9-10H2,1H3,(H,16,17).
What are the key properties of 6-(2-propoxybenzoyl)piperidin-2-one?
6-(2-propoxybenzoyl)piperidin-2-one has a molecular weight of 261.32 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-propoxybenzoyl)piperidin-2-one is sourced from PubChem (CID 54196538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).