2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide

C9H15N3O2 — CID 158776534

IUPAC2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide
SMILESC=C1NC(=O)CCC1N(C)CC(N)=O
InChIInChI=1S/C9H15N3O2/c1-6-7(3-4-9(14)11-6)12(2)5-8(10)13/h7H,1,3-5H2,2H3,(H2,10,13)(H,11,14)
InChIKeyGGXXPBZHQHQYMY-UHFFFAOYSA-N
MW197.24 g/mol
LogP-0.80
Rot. Bonds3

About 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide

2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide (PubChem CID 158776534) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide.

Molecular Properties

Compound Name2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide
PubChem CID158776534
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide
SMILESC=C1NC(=O)CCC1N(C)CC(N)=O
InChIInChI=1S/C9H15N3O2/c1-6-7(3-4-9(14)11-6)12(2)5-8(10)13/h7H,1,3-5H2,2H3,(H2,10,13)(H,11,14)
InChIKeyGGXXPBZHQHQYMY-UHFFFAOYSA-N
XLogP-0.80
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 5-0.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide?
The IUPAC name of 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide (CID 158776534) is 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide.
What is the SMILES notation for 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide?
The canonical SMILES for 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide is C=C1NC(=O)CCC1N(C)CC(N)=O.
What is the InChIKey of 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide?
The InChIKey is GGXXPBZHQHQYMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-6-7(3-4-9(14)11-6)12(2)5-8(10)13/h7H,1,3-5H2,2H3,(H2,10,13)(H,11,14).
What are the key properties of 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide?
2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide has a molecular weight of 197.24 g/mol, XLogP of -0.80, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(2-methylidene-6-oxopiperidin-3-yl)amino]acetamide is sourced from PubChem (CID 158776534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).