N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide

C9H16N2O3 — CID 19022148

IUPACN-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide
SMILESCON(C)C(=O)N1C(=O)CCC1(C)C
InChIInChI=1S/C9H16N2O3/c1-9(2)6-5-7(12)11(9)8(13)10(3)14-4/h5-6H2,1-4H3
InChIKeyIHYQDDAJRUCFGY-UHFFFAOYSA-N
MW200.24 g/mol
LogP1.00
Rot. Bonds1

About N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide

N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide (PubChem CID 19022148) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide
PubChem CID19022148
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC NameN-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide
SMILESCON(C)C(=O)N1C(=O)CCC1(C)C
InChIInChI=1S/C9H16N2O3/c1-9(2)6-5-7(12)11(9)8(13)10(3)14-4/h5-6H2,1-4H3
InChIKeyIHYQDDAJRUCFGY-UHFFFAOYSA-N
XLogP1.00
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide 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 N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide?
The IUPAC name of N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide (CID 19022148) is N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide.
What is the SMILES notation for N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide?
The canonical SMILES for N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide is CON(C)C(=O)N1C(=O)CCC1(C)C.
What is the InChIKey of N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide?
The InChIKey is IHYQDDAJRUCFGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c1-9(2)6-5-7(12)11(9)8(13)10(3)14-4/h5-6H2,1-4H3.
What are the key properties of N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide?
N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide has a molecular weight of 200.24 g/mol, XLogP of 1.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N,2,2-trimethyl-5-oxopyrrolidine-1-carboxamide is sourced from PubChem (CID 19022148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).