2-Piperidinocyclohexan-1-one hydrochloride

C11H20ClNO — CID 3014571

IUPAC2-piperidin-1-ylcyclohexan-1-one;hydrochloride
SMILESC1CCN(CC1)C2CCCCC2=O.Cl
InChIInChI=1S/C11H19NO.ClH/c13-11-7-3-2-6-10(11)12-8-4-1-5-9-12;/h10H,1-9H2;1H
InChIKeyUHXUDNGJIZOHID-UHFFFAOYSA-N
MW217.73 g/mol
LogP—
Rot. Bonds1

About 2-Piperidinocyclohexan-1-one hydrochloride

2-Piperidinocyclohexan-1-one hydrochloride (PubChem CID 3014571) has the molecular formula C11H20ClNO and a molecular weight of 217.73 g/mol. Its IUPAC name is 2-piperidin-1-ylcyclohexan-1-one;hydrochloride.

Molecular Properties

Compound Name2-Piperidinocyclohexan-1-one hydrochloride
PubChem CID3014571
Molecular FormulaC11H20ClNO
Molecular Weight217.73 g/mol
Exact Mass217.12
IUPAC Name2-piperidin-1-ylcyclohexan-1-one;hydrochloride
SMILESC1CCN(CC1)C2CCCCC2=O.Cl
InChIInChI=1S/C11H19NO.ClH/c13-11-7-3-2-6-10(11)12-8-4-1-5-9-12;/h10H,1-9H2;1H
InChIKeyUHXUDNGJIZOHID-UHFFFAOYSA-N
XLogP—
TPSA20.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity185

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Piperidin-1-yl)cyclohexan-1-one
CID 100139
2-(Diethylamino)cyclohexan-1-one
CID 13085448
2-(Azepan-1-yl)cyclohexan-1-one
CID 43794484
1-(1-Methylpiperidin-2-yl)ethanone
CID 262594
2-(Pyrrolidin-1-yl)cyclohexanone
CID 12649075
1-[(2R)-1-methylpiperidin-2-yl]ethanone
CID 53958375
N-2-ethylhexanoylpiperidine
CID 129727946
2-(3,5-Dimethylpiperidin-1-yl)cyclohexan-1-one
CID 43794282
3-Piperidino-2-octanone
CID 13807289
1-[1-(2-Fluoroethyl)piperidin-2-yl]ethanone
CID 80694723
1-[1-(3-Fluoropropyl)piperidin-2-yl]ethanone
CID 81105928
2-(3-Fluoropiperidin-1-yl)cyclohexan-1-one
CID 164659303

Frequently Asked Questions

What is the IUPAC name of 2-Piperidinocyclohexan-1-one hydrochloride?
The IUPAC name of 2-Piperidinocyclohexan-1-one hydrochloride (CID 3014571) is 2-piperidin-1-ylcyclohexan-1-one;hydrochloride.
What is the SMILES notation for 2-Piperidinocyclohexan-1-one hydrochloride?
The canonical SMILES for 2-Piperidinocyclohexan-1-one hydrochloride is C1CCN(CC1)C2CCCCC2=O.Cl.
What is the InChIKey of 2-Piperidinocyclohexan-1-one hydrochloride?
The InChIKey is UHXUDNGJIZOHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO.ClH/c13-11-7-3-2-6-10(11)12-8-4-1-5-9-12;/h10H,1-9H2;1H.
What are the key properties of 2-Piperidinocyclohexan-1-one hydrochloride?
2-Piperidinocyclohexan-1-one hydrochloride has a molecular weight of 217.73 g/mol, XLogP of not available, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Piperidinocyclohexan-1-one hydrochloride is sourced from PubChem (CID 3014571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).