5-amino-1-methyl-6-methylidenepiperidin-2-one

C7H12N2O — CID 88976276

IUPAC5-amino-1-methyl-6-methylidenepiperidin-2-one
SMILESC=C1C(N)CCC(=O)N1C
InChIInChI=1S/C7H12N2O/c1-5-6(8)3-4-7(10)9(5)2/h6H,1,3-4,8H2,2H3
InChIKeyCYGMIJRNFZWAAK-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.08
Rot. Bonds

About 5-amino-1-methyl-6-methylidenepiperidin-2-one

5-amino-1-methyl-6-methylidenepiperidin-2-one (PubChem CID 88976276) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 5-amino-1-methyl-6-methylidenepiperidin-2-one.

Molecular Properties

Compound Name5-amino-1-methyl-6-methylidenepiperidin-2-one
PubChem CID88976276
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name5-amino-1-methyl-6-methylidenepiperidin-2-one
SMILESC=C1C(N)CCC(=O)N1C
InChIInChI=1S/C7H12N2O/c1-5-6(8)3-4-7(10)9(5)2/h6H,1,3-4,8H2,2H3
InChIKeyCYGMIJRNFZWAAK-UHFFFAOYSA-N
XLogP0.08
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-6-methylidenepiperidin-2-one?
The IUPAC name of 5-amino-1-methyl-6-methylidenepiperidin-2-one (CID 88976276) is 5-amino-1-methyl-6-methylidenepiperidin-2-one.
What is the SMILES notation for 5-amino-1-methyl-6-methylidenepiperidin-2-one?
The canonical SMILES for 5-amino-1-methyl-6-methylidenepiperidin-2-one is C=C1C(N)CCC(=O)N1C.
What is the InChIKey of 5-amino-1-methyl-6-methylidenepiperidin-2-one?
The InChIKey is CYGMIJRNFZWAAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5-6(8)3-4-7(10)9(5)2/h6H,1,3-4,8H2,2H3.
What are the key properties of 5-amino-1-methyl-6-methylidenepiperidin-2-one?
5-amino-1-methyl-6-methylidenepiperidin-2-one has a molecular weight of 140.19 g/mol, XLogP of 0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-6-methylidenepiperidin-2-one is sourced from PubChem (CID 88976276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).