2-[methyl-(2-oxocycloheptyl)amino]acetamide

C10H18N2O2 — CID 60863457

IUPAC2-[methyl-(2-oxocycloheptyl)amino]acetamide
SMILESCN(CC(N)=O)C1CCCCCC1=O
InChIInChI=1S/C10H18N2O2/c1-12(7-10(11)14)8-5-3-2-4-6-9(8)13/h8H,2-7H2,1H3,(H2,11,14)
InChIKeyLKWDOJBIHIVECF-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.31
Rot. Bonds3

About 2-[methyl-(2-oxocycloheptyl)amino]acetamide

2-[methyl-(2-oxocycloheptyl)amino]acetamide (PubChem CID 60863457) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-[methyl-(2-oxocycloheptyl)amino]acetamide.

Molecular Properties

Compound Name2-[methyl-(2-oxocycloheptyl)amino]acetamide
PubChem CID60863457
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name2-[methyl-(2-oxocycloheptyl)amino]acetamide
SMILESCN(CC(N)=O)C1CCCCCC1=O
InChIInChI=1S/C10H18N2O2/c1-12(7-10(11)14)8-5-3-2-4-6-9(8)13/h8H,2-7H2,1H3,(H2,11,14)
InChIKeyLKWDOJBIHIVECF-UHFFFAOYSA-N
XLogP0.31
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl-(2-oxocycloheptyl)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-oxocycloheptyl)amino]acetamide?
The IUPAC name of 2-[methyl-(2-oxocycloheptyl)amino]acetamide (CID 60863457) is 2-[methyl-(2-oxocycloheptyl)amino]acetamide.
What is the SMILES notation for 2-[methyl-(2-oxocycloheptyl)amino]acetamide?
The canonical SMILES for 2-[methyl-(2-oxocycloheptyl)amino]acetamide is CN(CC(N)=O)C1CCCCCC1=O.
What is the InChIKey of 2-[methyl-(2-oxocycloheptyl)amino]acetamide?
The InChIKey is LKWDOJBIHIVECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-12(7-10(11)14)8-5-3-2-4-6-9(8)13/h8H,2-7H2,1H3,(H2,11,14).
What are the key properties of 2-[methyl-(2-oxocycloheptyl)amino]acetamide?
2-[methyl-(2-oxocycloheptyl)amino]acetamide has a molecular weight of 198.27 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(2-oxocycloheptyl)amino]acetamide is sourced from PubChem (CID 60863457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).