5-amino-1-methylpiperidin-2-one;hydrochloride

C6H13ClN2O — CID 67228252

IUPAC5-amino-1-methylpiperidin-2-one;hydrochloride
SMILESCN1CC(N)CCC1=O.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-8-4-5(7)2-3-6(8)9;/h5H,2-4,7H2,1H3;1H
InChIKeyJZSNGORVKPJBMJ-UHFFFAOYSA-N
MW164.64 g/mol
LogP-0.01
Rot. Bonds

About 5-amino-1-methylpiperidin-2-one;hydrochloride

5-amino-1-methylpiperidin-2-one;hydrochloride (PubChem CID 67228252) has the molecular formula C6H13ClN2O and a molecular weight of 164.64 g/mol. Its IUPAC name is 5-amino-1-methylpiperidin-2-one;hydrochloride.

Molecular Properties

Compound Name5-amino-1-methylpiperidin-2-one;hydrochloride
PubChem CID67228252
Molecular FormulaC6H13ClN2O
Molecular Weight164.64 g/mol
Exact Mass164.07
IUPAC Name5-amino-1-methylpiperidin-2-one;hydrochloride
SMILESCN1CC(N)CCC1=O.Cl
InChIInChI=1S/C6H12N2O.ClH/c1-8-4-5(7)2-3-6(8)9;/h5H,2-4,7H2,1H3;1H
InChIKeyJZSNGORVKPJBMJ-UHFFFAOYSA-N
XLogP-0.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.64
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-amino-1-methylpiperidin-2-one;methane
CID 178188727
4-amino-1-methylpyrrolidin-2-one;ethane
CID 145355415
(5R)-5-ethyl-1-methylpiperidin-2-one
CID 170386664
5-amino-1-oxidopiperidin-2-one
CID 87348703
5-amino-1-(2-hydroxyethyl)piperidin-2-one;hydrochloride
CID 69008245
(5S)-5-amino-1-propan-2-ylpiperidin-2-one
CID 95241415
5-amino-1-butylpiperidin-2-one
CID 64978058
5-amino-1-(3,3-dimethylbutyl)piperidin-2-one
CID 64977979
5-amino-1-pentylpiperidin-2-one
CID 64977965
5-amino-1-dodecylpiperidin-2-one
CID 64977984
1-methyl-6-oxopiperidine-3-carboxylic acid
CID 25247731
(5R)-5-[(2R)-2-aminopentyl]-1-methylpiperidin-2-one
CID 59201537

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methylpiperidin-2-one;hydrochloride?
The IUPAC name of 5-amino-1-methylpiperidin-2-one;hydrochloride (CID 67228252) is 5-amino-1-methylpiperidin-2-one;hydrochloride.
What is the SMILES notation for 5-amino-1-methylpiperidin-2-one;hydrochloride?
The canonical SMILES for 5-amino-1-methylpiperidin-2-one;hydrochloride is CN1CC(N)CCC1=O.Cl.
What is the InChIKey of 5-amino-1-methylpiperidin-2-one;hydrochloride?
The InChIKey is JZSNGORVKPJBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.ClH/c1-8-4-5(7)2-3-6(8)9;/h5H,2-4,7H2,1H3;1H.
What are the key properties of 5-amino-1-methylpiperidin-2-one;hydrochloride?
5-amino-1-methylpiperidin-2-one;hydrochloride has a molecular weight of 164.64 g/mol, XLogP of -0.01, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methylpiperidin-2-one;hydrochloride is sourced from PubChem (CID 67228252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).