cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone

C18H32N2O3 — CID 157039378

IUPACcyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCC(CN2CCC(O)CC2CO)CC1
InChIInChI=1S/C18H32N2O3/c21-13-16-11-17(22)7-10-20(16)12-14-5-8-19(9-6-14)18(23)15-3-1-2-4-15/h14-17,21-22H,1-13H2
InChIKeyUZCGJIPGZGAREV-UHFFFAOYSA-N
MW324.47 g/mol
LogP1.23
Rot. Bonds4

About cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone

cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone (PubChem CID 157039378) has the molecular formula C18H32N2O3 and a molecular weight of 324.47 g/mol. Its IUPAC name is cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone
PubChem CID157039378
Molecular FormulaC18H32N2O3
Molecular Weight324.47 g/mol
Exact Mass324.24
IUPAC Namecyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone
SMILESO=C(C1CCCC1)N1CCC(CN2CCC(O)CC2CO)CC1
InChIInChI=1S/C18H32N2O3/c21-13-16-11-17(22)7-10-20(16)12-14-5-8-19(9-6-14)18(23)15-3-1-2-4-15/h14-17,21-22H,1-13H2
InChIKeyUZCGJIPGZGAREV-UHFFFAOYSA-N
XLogP1.23
TPSA64.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-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

[4-[[4-Hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]-[4-(trifluoromethyl)cyclohexyl]methanone
CID 157039583
cyclopentyl-[4-[[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]methanone
CID 155286465
2-cyclopentyl-1-[4-[[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-methylpiperidin-1-yl]methyl]piperidin-1-yl]ethanone
CID 155302736
2-Cyclopentyl-1-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]ethanone
CID 155721028
Cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
CID 155721081
2-Cyclopentyl-1-[4-[(4-hydroxypiperidin-1-yl)methyl]piperidin-1-yl]ethanone
CID 157039102
cyclopentyl-[4-[[(3R,5S)-3,4,5-trihydroxypiperidin-1-yl]methyl]piperidin-1-yl]methanone
CID 157039162
1-[4-[[4-Hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 157039365
cyclopentyl-[4-[[(2R,3R,4R,5S)-3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone
CID 157039368
2-Cyclopentyl-1-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]ethanone
CID 157039414
Cyclopropyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone
CID 157039452
cyclopentyl-[4-[[(2S,3R,4R,5S)-3,4,5-trihydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone
CID 157039543

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone (CID 157039378) is cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone is O=C(C1CCCC1)N1CCC(CN2CCC(O)CC2CO)CC1.
What is the InChIKey of cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone?
The InChIKey is UZCGJIPGZGAREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O3/c21-13-16-11-17(22)7-10-20(16)12-14-5-8-19(9-6-14)18(23)15-3-1-2-4-15/h14-17,21-22H,1-13H2.
What are the key properties of cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone?
cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone has a molecular weight of 324.47 g/mol, XLogP of 1.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-[[4-hydroxy-2-(hydroxymethyl)piperidin-1-yl]methyl]piperidin-1-yl]methanone is sourced from PubChem (CID 157039378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).