4-amino-1-(2-chlorophenyl)piperidin-2-one

C11H13ClN2O — CID 83642987

IUPAC4-amino-1-(2-chlorophenyl)piperidin-2-one
SMILESNC1CCN(c2ccccc2Cl)C(=O)C1
InChIInChI=1S/C11H13ClN2O/c12-9-3-1-2-4-10(9)14-6-5-8(13)7-11(14)15/h1-4,8H,5-7,13H2
InChIKeyZTHDZGBAPOLLRN-UHFFFAOYSA-N
MW224.69 g/mol
LogP1.79
Rot. Bonds1

About 4-amino-1-(2-chlorophenyl)piperidin-2-one

4-amino-1-(2-chlorophenyl)piperidin-2-one (PubChem CID 83642987) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is 4-amino-1-(2-chlorophenyl)piperidin-2-one.

Molecular Properties

Compound Name4-amino-1-(2-chlorophenyl)piperidin-2-one
PubChem CID83642987
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC Name4-amino-1-(2-chlorophenyl)piperidin-2-one
SMILESNC1CCN(c2ccccc2Cl)C(=O)C1
InChIInChI=1S/C11H13ClN2O/c12-9-3-1-2-4-10(9)14-6-5-8(13)7-11(14)15/h1-4,8H,5-7,13H2
InChIKeyZTHDZGBAPOLLRN-UHFFFAOYSA-N
XLogP1.79
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-amino-1-(2-chlorophenyl)pyrrolidin-2-one
CID 11128620
1-(2-chlorophenyl)-4-sulfanylpyrrolidin-2-one
CID 168710154
(3S)-1-(2-chlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 42579807
N-(4-aminocyclohexyl)-1-(2-chlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 119474578
1-[(3R)-1-(2-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]piperidine-4-carboxamide
CID 32978569
1-(2-chlorophenyl)-3-hydroxypiperidin-2-one
CID 117014113
1-(2-chlorophenyl)-4-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]pyrrolidin-2-one
CID 112767128
1-(2-chlorophenyl)-2,2-dimethylpiperidin-4-amine
CID 117020121
(3S)-1-[(3S)-1-(2-chlorophenyl)-5-oxopyrrolidine-3-carbonyl]pyrrolidine-3-carboxylic acid
CID 124703341
4-amino-1-[2-(benzimidazol-1-yl)quinolin-8-yl]piperidin-2-one
CID 70928974
3-[4-(2-chlorophenyl)piperazin-1-yl]cyclopentan-1-amine
CID 79468286
1-(2-chlorophenyl)-4-(4-methylpiperazine-1-carbonyl)pyrrolidin-2-one
CID 84504102

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(2-chlorophenyl)piperidin-2-one?
The IUPAC name of 4-amino-1-(2-chlorophenyl)piperidin-2-one (CID 83642987) is 4-amino-1-(2-chlorophenyl)piperidin-2-one.
What is the SMILES notation for 4-amino-1-(2-chlorophenyl)piperidin-2-one?
The canonical SMILES for 4-amino-1-(2-chlorophenyl)piperidin-2-one is NC1CCN(c2ccccc2Cl)C(=O)C1.
What is the InChIKey of 4-amino-1-(2-chlorophenyl)piperidin-2-one?
The InChIKey is ZTHDZGBAPOLLRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c12-9-3-1-2-4-10(9)14-6-5-8(13)7-11(14)15/h1-4,8H,5-7,13H2.
What are the key properties of 4-amino-1-(2-chlorophenyl)piperidin-2-one?
4-amino-1-(2-chlorophenyl)piperidin-2-one has a molecular weight of 224.69 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(2-chlorophenyl)piperidin-2-one is sourced from PubChem (CID 83642987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).