phenyl-(2-propylpiperidin-1-yl)methanone

C15H21NO — CID 16637839

IUPACphenyl-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)c1ccccc1
InChIInChI=1S/C15H21NO/c1-2-8-14-11-6-7-12-16(14)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3
InChIKeyZTVDXUDRHVAAGS-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.48
Rot. Bonds3

About phenyl-(2-propylpiperidin-1-yl)methanone

phenyl-(2-propylpiperidin-1-yl)methanone (PubChem CID 16637839) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is phenyl-(2-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Namephenyl-(2-propylpiperidin-1-yl)methanone
PubChem CID16637839
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Namephenyl-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)c1ccccc1
InChIInChI=1S/C15H21NO/c1-2-8-14-11-6-7-12-16(14)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3
InChIKeyZTVDXUDRHVAAGS-UHFFFAOYSA-N
XLogP3.48
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze phenyl-(2-propylpiperidin-1-yl)methanone 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

2-[3-(2-propylpiperidine-1-carbonyl)phenyl]acetic acid
CID 136546901
phenyl-[(2S)-2-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]methanone
CID 29348343
(2-ethylpyrrolidin-1-yl)-phenylmethanone
CID 20577009
phenyl-[2-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]methanone;hydrochloride
CID 52984889
(2-hydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 83056508
phenyl-[(2S)-2-(2-piperidin-1-ylethyl)piperidin-1-yl]methanone
CID 40776058
[4-(2-aminoethyl)phenyl]-(2-propylpiperidin-1-yl)methanone
CID 83053387
(2,6-dihydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 107689544
(4-fluorophenyl)-(2-propylpyrrolidin-1-yl)methanone
CID 142034272
[(2S)-2-benzylpiperidin-1-yl]-phenylmethanone
CID 155929798
[4-[(2S)-2-ethylpiperidine-1-carbonyl]phenyl]-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 1087323
(3-chloro-4-hydroxyphenyl)-(2-propylpiperidin-1-yl)methanone
CID 83055938

Frequently Asked Questions

What is the IUPAC name of phenyl-(2-propylpiperidin-1-yl)methanone?
The IUPAC name of phenyl-(2-propylpiperidin-1-yl)methanone (CID 16637839) is phenyl-(2-propylpiperidin-1-yl)methanone.
What is the SMILES notation for phenyl-(2-propylpiperidin-1-yl)methanone?
The canonical SMILES for phenyl-(2-propylpiperidin-1-yl)methanone is CCCC1CCCCN1C(=O)c1ccccc1.
What is the InChIKey of phenyl-(2-propylpiperidin-1-yl)methanone?
The InChIKey is ZTVDXUDRHVAAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-8-14-11-6-7-12-16(14)15(17)13-9-4-3-5-10-13/h3-5,9-10,14H,2,6-8,11-12H2,1H3.
What are the key properties of phenyl-(2-propylpiperidin-1-yl)methanone?
phenyl-(2-propylpiperidin-1-yl)methanone has a molecular weight of 231.34 g/mol, XLogP of 3.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(2-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 16637839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).