cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone

C14H25NO2 — CID 42083441

IUPACcyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(C1CCCCC1)N1CCCC[C@H]1CCO
InChIInChI=1S/C14H25NO2/c16-11-9-13-8-4-5-10-15(13)14(17)12-6-2-1-3-7-12/h12-13,16H,1-11H2/t13-/m0/s1
InChIKeyHMPPGLMLUIZMRM-ZDUSSCGKSA-N
MW239.36 g/mol
LogP2.33
Rot. Bonds3

About cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone

cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone (PubChem CID 42083441) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone
PubChem CID42083441
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Namecyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone
SMILESO=C(C1CCCCC1)N1CCCC[C@H]1CCO
InChIInChI=1S/C14H25NO2/c16-11-9-13-8-4-5-10-15(13)14(17)12-6-2-1-3-7-12/h12-13,16H,1-11H2/t13-/m0/s1
InChIKeyHMPPGLMLUIZMRM-ZDUSSCGKSA-N
XLogP2.33
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The IUPAC name of cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone (CID 42083441) is cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The canonical SMILES for cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone is O=C(C1CCCCC1)N1CCCC[C@H]1CCO.
What is the InChIKey of cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone?
The InChIKey is HMPPGLMLUIZMRM-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H25NO2/c16-11-9-13-8-4-5-10-15(13)14(17)12-6-2-1-3-7-12/h12-13,16H,1-11H2/t13-/m0/s1.
What are the key properties of cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone?
cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone has a molecular weight of 239.36 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[(2S)-2-(2-hydroxyethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 42083441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).