(5S)-5-amino-1-phenylpiperidin-2-one

C11H14N2O — CID 91616936

IUPAC(5S)-5-amino-1-phenylpiperidin-2-one
SMILESN[C@H]1CCC(=O)N(c2ccccc2)C1
InChIInChI=1S/C11H14N2O/c12-9-6-7-11(14)13(8-9)10-4-2-1-3-5-10/h1-5,9H,6-8,12H2/t9-/m0/s1
InChIKeyBQBWXGWESJKIOJ-VIFPVBQESA-N
MW190.25 g/mol
LogP1.14
Rot. Bonds1

About (5S)-5-amino-1-phenylpiperidin-2-one

(5S)-5-amino-1-phenylpiperidin-2-one (PubChem CID 91616936) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is (5S)-5-amino-1-phenylpiperidin-2-one.

Molecular Properties

Compound Name(5S)-5-amino-1-phenylpiperidin-2-one
PubChem CID91616936
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name(5S)-5-amino-1-phenylpiperidin-2-one
SMILESN[C@H]1CCC(=O)N(c2ccccc2)C1
InChIInChI=1S/C11H14N2O/c12-9-6-7-11(14)13(8-9)10-4-2-1-3-5-10/h1-5,9H,6-8,12H2/t9-/m0/s1
InChIKeyBQBWXGWESJKIOJ-VIFPVBQESA-N
XLogP1.14
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(aminomethyl)-1-phenylazepan-2-one
CID 84683954
(3S)-N'-hydroxy-6-oxo-1-phenylpiperidine-3-carboximidamide
CID 125449083
6-amino-1-(4-methylphenyl)azepan-2-one
CID 84683957
4-amino-1-(4-benzylphenyl)pyrrolidin-2-one
CID 168701095
4-amino-1-(3-phenylphenyl)pyrrolidin-2-one
CID 168700983
4-(bromomethyl)-1-phenylpyrrolidin-2-one
CID 23591967
1-phenyl-4-(sulfanylmethyl)pyrrolidin-2-one
CID 168672207
(3R)-1-phenylpyrrolidin-3-amine
CID 51663648
(3S,4S)-4-amino-5-oxo-1-phenylpyrrolidine-3-carboxylic acid
CID 167011785
5-(4-amino-2-oxopyrrolidin-1-yl)-2-phenylpyridazin-3-one
CID 168700057
1-(4-chlorophenyl)-3-(6-oxo-1-phenylpiperidin-3-yl)urea
CID 153326080
4-amino-1-(3-bromophenyl)pyrrolidin-2-one
CID 43521015

Frequently Asked Questions

What is the IUPAC name of (5S)-5-amino-1-phenylpiperidin-2-one?
The IUPAC name of (5S)-5-amino-1-phenylpiperidin-2-one (CID 91616936) is (5S)-5-amino-1-phenylpiperidin-2-one.
What is the SMILES notation for (5S)-5-amino-1-phenylpiperidin-2-one?
The canonical SMILES for (5S)-5-amino-1-phenylpiperidin-2-one is N[C@H]1CCC(=O)N(c2ccccc2)C1.
What is the InChIKey of (5S)-5-amino-1-phenylpiperidin-2-one?
The InChIKey is BQBWXGWESJKIOJ-VIFPVBQESA-N. The full InChI is InChI=1S/C11H14N2O/c12-9-6-7-11(14)13(8-9)10-4-2-1-3-5-10/h1-5,9H,6-8,12H2/t9-/m0/s1.
What are the key properties of (5S)-5-amino-1-phenylpiperidin-2-one?
(5S)-5-amino-1-phenylpiperidin-2-one has a molecular weight of 190.25 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-amino-1-phenylpiperidin-2-one is sourced from PubChem (CID 91616936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).