[(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone

C15H27NO2 — CID 126835510

IUPAC[(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone
SMILESCC1CC(C(=O)N2CCC[C@@H](O)C2)CC(C)(C)C1
InChIInChI=1S/C15H27NO2/c1-11-7-12(9-15(2,3)8-11)14(18)16-6-4-5-13(17)10-16/h11-13,17H,4-10H2,1-3H3/t11?,12?,13-/m1/s1
InChIKeyYKFZCGYZCGITRY-WXRRBKDZSA-N
MW253.39 g/mol
LogP2.43
Rot. Bonds1

About [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone

[(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone (PubChem CID 126835510) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone.

Molecular Properties

Compound Name[(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone
PubChem CID126835510
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name[(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone
SMILESCC1CC(C(=O)N2CCC[C@@H](O)C2)CC(C)(C)C1
InChIInChI=1S/C15H27NO2/c1-11-7-12(9-15(2,3)8-11)14(18)16-6-4-5-13(17)10-16/h11-13,17H,4-10H2,1-3H3/t11?,12?,13-/m1/s1
InChIKeyYKFZCGYZCGITRY-WXRRBKDZSA-N
XLogP2.43
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-Ethylcyclohexyl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 121516217
(3-Hydroxypiperidin-1-yl)-[4-(trifluoromethyl)cyclohexyl]methanone
CID 81932388
(4,4-Difluorocyclohexyl)-(3-hydroxypiperidin-1-yl)methanone
CID 81932422
(3-Hydroxy-4-methylpiperidin-1-yl)-[4-(trifluoromethyl)cyclohexyl]methanone
CID 102958800
(4,4-Difluorocyclohexyl)-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 103859881
(3-Hydroxy-4-methylpiperidin-1-yl)-[2-(trifluoromethyl)cyclohexyl]methanone
CID 103900383
(4,4-Difluorocyclohexyl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 103900819
(3-Hydroxy-4-methylpiperidin-1-yl)-[3-(trifluoromethyl)cyclohexyl]methanone
CID 103900839
[(3S)-3-hydroxypiperidin-1-yl]-[3-(trifluoromethyl)cyclohexyl]methanone
CID 107224457
[(3S)-3-hydroxypiperidin-1-yl]-[4-(trifluoromethyl)cyclohexyl]methanone
CID 107224557
(4,4-difluorocyclohexyl)-[(3S)-3-hydroxypiperidin-1-yl]methanone
CID 107224664
(4,4-Difluorocyclohexyl)-[4-ethyl-4-(hydroxymethyl)piperidin-1-yl]methanone
CID 109907991

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone?
The IUPAC name of [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone (CID 126835510) is [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone.
What is the SMILES notation for [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone?
The canonical SMILES for [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone is CC1CC(C(=O)N2CCC[C@@H](O)C2)CC(C)(C)C1.
What is the InChIKey of [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone?
The InChIKey is YKFZCGYZCGITRY-WXRRBKDZSA-N. The full InChI is InChI=1S/C15H27NO2/c1-11-7-12(9-15(2,3)8-11)14(18)16-6-4-5-13(17)10-16/h11-13,17H,4-10H2,1-3H3/t11?,12?,13-/m1/s1.
What are the key properties of [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone?
[(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone has a molecular weight of 253.39 g/mol, XLogP of 2.43, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-hydroxypiperidin-1-yl]-(3,3,5-trimethylcyclohexyl)methanone is sourced from PubChem (CID 126835510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).