5-amino-3,3-dimethylpiperidin-2-one

C7H14N2O — CID 131610906

IUPAC5-amino-3,3-dimethylpiperidin-2-one
SMILESCC1(C)CC(N)CNC1=O
InChIInChI=1S/C7H14N2O/c1-7(2)3-5(8)4-9-6(7)10/h5H,3-4,8H2,1-2H3,(H,9,10)
InChIKeyFRJLNMXZKXCNCQ-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.14
Rot. Bonds

About 5-amino-3,3-dimethylpiperidin-2-one

5-amino-3,3-dimethylpiperidin-2-one (PubChem CID 131610906) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 5-amino-3,3-dimethylpiperidin-2-one.

Molecular Properties

Compound Name5-amino-3,3-dimethylpiperidin-2-one
PubChem CID131610906
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name5-amino-3,3-dimethylpiperidin-2-one
SMILESCC1(C)CC(N)CNC1=O
InChIInChI=1S/C7H14N2O/c1-7(2)3-5(8)4-9-6(7)10/h5H,3-4,8H2,1-2H3,(H,9,10)
InChIKeyFRJLNMXZKXCNCQ-UHFFFAOYSA-N
XLogP-0.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3,3-dimethylpiperidin-2-one?
The IUPAC name of 5-amino-3,3-dimethylpiperidin-2-one (CID 131610906) is 5-amino-3,3-dimethylpiperidin-2-one.
What is the SMILES notation for 5-amino-3,3-dimethylpiperidin-2-one?
The canonical SMILES for 5-amino-3,3-dimethylpiperidin-2-one is CC1(C)CC(N)CNC1=O.
What is the InChIKey of 5-amino-3,3-dimethylpiperidin-2-one?
The InChIKey is FRJLNMXZKXCNCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-7(2)3-5(8)4-9-6(7)10/h5H,3-4,8H2,1-2H3,(H,9,10).
What are the key properties of 5-amino-3,3-dimethylpiperidin-2-one?
5-amino-3,3-dimethylpiperidin-2-one has a molecular weight of 142.20 g/mol, XLogP of -0.14, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3,3-dimethylpiperidin-2-one is sourced from PubChem (CID 131610906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).