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

C18H32N2O2 — CID 155721081

IUPACcyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
SMILESCC1CC(O)CCN1CC1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C18H32N2O2/c1-14-12-17(21)8-11-20(14)13-15-6-9-19(10-7-15)18(22)16-4-2-3-5-16/h14-17,21H,2-13H2,1H3
InChIKeyVBLQAVKBAHMAOC-UHFFFAOYSA-N
MW308.47 g/mol
LogP2.26
Rot. Bonds3

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

cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone (PubChem CID 155721081) has the molecular formula C18H32N2O2 and a molecular weight of 308.47 g/mol. Its IUPAC name is cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
PubChem CID155721081
Molecular FormulaC18H32N2O2
Molecular Weight308.47 g/mol
Exact Mass308.25
IUPAC Namecyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone
SMILESCC1CC(O)CCN1CC1CCN(C(=O)C2CCCC2)CC1
InChIInChI=1S/C18H32N2O2/c1-14-12-17(21)8-11-20(14)13-15-6-9-19(10-7-15)18(22)16-4-2-3-5-16/h14-17,21H,2-13H2,1H3
InChIKeyVBLQAVKBAHMAOC-UHFFFAOYSA-N
XLogP2.26
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.47
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl[(3S,4S)-3-(dimethylamino)-4-(hydroxymethyl)tetrahydro-1(2H)-pyridinyl]methanone
CID 110197498
[4-[(4-Hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-[4-(trifluoromethyl)cyclohexyl]methanone
CID 155721036
Tert-butyl 4-[2-(4-hydroxy-2-methylpiperidin-1-yl)-2-oxoethyl]piperidine-1-carboxylate
CID 11501010
3-[2-(4-Hydroxypiperidin-1-yl)-2-oxoethyl]-1-(1-methylpiperidin-4-yl)piperidin-2-one
CID 20590488
Cyclopentyl(4-hydroxypiperidin-1-yl)methanone
CID 39959573
1-[3-[3-(4-Hydroxypiperidin-1-yl)-2-methyl-3-oxopropyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 126670272
2-[1-[1-(Dimethylamino)pentan-3-yl]-2-oxopiperidin-3-yl]acetaldehyde;1-methylpiperidin-4-ol
CID 141952771
2-[(3R)-1-[(2R)-2-hydroxy-3-methylbutan-2-yl]piperidin-3-yl]-N-[(2R)-4-hydroxy-2-methylpentyl]-N-methylacetamide
CID 145399682
3-Cyclopentyl-1-(2-ethyl-4-hydroxypiperidin-1-yl)propan-1-one
CID 150907819
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
1-[4-[(4-Hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]-3,3-dimethylbutan-1-one
CID 155721017

Frequently Asked Questions

What is the IUPAC name of cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone?
The IUPAC name of cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone (CID 155721081) is cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone.
What is the SMILES notation for cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone?
The canonical SMILES for cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone is CC1CC(O)CCN1CC1CCN(C(=O)C2CCCC2)CC1.
What is the InChIKey of cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone?
The InChIKey is VBLQAVKBAHMAOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2/c1-14-12-17(21)8-11-20(14)13-15-6-9-19(10-7-15)18(22)16-4-2-3-5-16/h14-17,21H,2-13H2,1H3.
What are the key properties of cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone?
cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone has a molecular weight of 308.47 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-[4-[(4-hydroxy-2-methylpiperidin-1-yl)methyl]piperidin-1-yl]methanone is sourced from PubChem (CID 155721081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).