cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone

C15H20N2O2 — CID 95833425

IUPACcyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCC(O)(c2cccnc2)CC1
InChIInChI=1S/C15H20N2O2/c18-14(12-3-1-4-12)17-9-6-15(19,7-10-17)13-5-2-8-16-11-13/h2,5,8,11-12,19H,1,3-4,6-7,9-10H2
InChIKeyQGYYPKLDLXIEFZ-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.69
Rot. Bonds2

About cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone

cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone (PubChem CID 95833425) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone
PubChem CID95833425
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Namecyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone
SMILESO=C(C1CCC1)N1CCC(O)(c2cccnc2)CC1
InChIInChI=1S/C15H20N2O2/c18-14(12-3-1-4-12)17-9-6-15(19,7-10-17)13-5-2-8-16-11-13/h2,5,8,11-12,19H,1,3-4,6-7,9-10H2
InChIKeyQGYYPKLDLXIEFZ-UHFFFAOYSA-N
XLogP1.69
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-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

(4S)-1-tert-butyl-4-(4-hydroxy-4-pyridin-3-ylpiperidine-1-carbonyl)pyrrolidin-2-one
CID 97112054
1-(azepan-1-yl)-2-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)ethanone
CID 126468362
1-[(3S)-3-(4-hydroxy-4-pyridin-3-ylpiperidine-1-carbonyl)-4-methylpiperazin-1-yl]ethanone
CID 95827555
[(3R,6S)-6-amino-1-(oxan-4-yl)azepan-3-yl]-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone
CID 165426775
9-hydroxy-9-pyridin-3-yl-3-azaspiro[5.5]undecane-3-carboxylic acid
CID 66755240
1-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)-2-[(3R)-oxolan-3-yl]ethanone
CID 126441295
1-methyl-4-pyridin-3-ylpiperidin-4-ol
CID 4172974
1-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)-3-[(3R)-1-methylpiperidin-3-yl]propan-1-one
CID 97197401
(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)-[(2S)-2-methyloxolan-2-yl]methanone
CID 126432712
(4S)-4-(4-hydroxy-4-pyridin-3-ylpiperidine-1-carbonyl)-1-(pyridin-2-ylmethyl)pyrrolidin-2-one
CID 97117430
N-benzyl-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
CID 1446435
ethyl 3-hydroxy-3-pyridin-3-ylpyrrolidine-1-carboxylate
CID 86101343

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone?
The IUPAC name of cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone (CID 95833425) is cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone.
What is the SMILES notation for cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone?
The canonical SMILES for cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone is O=C(C1CCC1)N1CCC(O)(c2cccnc2)CC1.
What is the InChIKey of cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone?
The InChIKey is QGYYPKLDLXIEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-14(12-3-1-4-12)17-9-6-15(19,7-10-17)13-5-2-8-16-11-13/h2,5,8,11-12,19H,1,3-4,6-7,9-10H2.
What are the key properties of cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone?
cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone has a molecular weight of 260.34 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 95833425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).