(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone

C13H23NO3 — CID 112531209

IUPAC(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone
SMILESCOC1CCC(C(=O)N2CCC(O)CC2)CC1
InChIInChI=1S/C13H23NO3/c1-17-12-4-2-10(3-5-12)13(16)14-8-6-11(15)7-9-14/h10-12,15H,2-9H2,1H3
InChIKeyRPEBWWVJEVDURV-UHFFFAOYSA-N
MW241.33 g/mol
LogP1.17
Rot. Bonds2

About (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone

(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone (PubChem CID 112531209) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone.

Molecular Properties

Compound Name(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone
PubChem CID112531209
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC Name(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone
SMILESCOC1CCC(C(=O)N2CCC(O)CC2)CC1
InChIInChI=1S/C13H23NO3/c1-17-12-4-2-10(3-5-12)13(16)14-8-6-11(15)7-9-14/h10-12,15H,2-9H2,1H3
InChIKeyRPEBWWVJEVDURV-UHFFFAOYSA-N
XLogP1.17
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

azepan-1-yl-(4-methoxycyclohexyl)methanone
CID 112530492
4-(4-hydroxypiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63782265
(4-aminocyclohexyl)-(4-hydroxypiperidin-1-yl)methanone
CID 20754665
1-[4-[4-[(4-methoxypiperidin-1-yl)methyl]piperidine-1-carbonyl]cyclohexyl]ethanone
CID 176683725
3-(4-methoxypiperidine-1-carbonyl)cyclobutan-1-one
CID 171109226
(4-methoxypiperidin-1-yl)-[1-(4-methylcyclohexyl)piperidin-4-yl]methanone
CID 171833705
methyl 4-(cyclopropanecarbonyl)piperazine-1-carboxylate
CID 60700298
[4-(dimethylamino)piperidin-1-yl]-(3-methoxycyclobutyl)methanone
CID 154866121
(4-butylcyclohexyl)-[4-(4-methoxypiperidin-1-yl)piperidin-1-yl]methanone
CID 90616537
1-[(3R)-1-(4-hydroxycyclohexanecarbonyl)pyrrolidin-3-yl]ethanone
CID 168882604
1-[4-[4-(4-acetylpiperazine-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 2375184
cyclopropyl-[4-(methylamino)piperidin-1-yl]methanone
CID 60817866

Frequently Asked Questions

What is the IUPAC name of (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone?
The IUPAC name of (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone (CID 112531209) is (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone.
What is the SMILES notation for (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone?
The canonical SMILES for (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone is COC1CCC(C(=O)N2CCC(O)CC2)CC1.
What is the InChIKey of (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone?
The InChIKey is RPEBWWVJEVDURV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c1-17-12-4-2-10(3-5-12)13(16)14-8-6-11(15)7-9-14/h10-12,15H,2-9H2,1H3.
What are the key properties of (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone?
(4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone has a molecular weight of 241.33 g/mol, XLogP of 1.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxypiperidin-1-yl)-(4-methoxycyclohexyl)methanone is sourced from PubChem (CID 112531209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).