N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide

C12H25N3O2 — CID 79202204

IUPACN-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide
SMILESCCCN(CC(=O)N(C)C)C(=O)C(C)CNC
InChIInChI=1S/C12H25N3O2/c1-6-7-15(9-11(16)14(4)5)12(17)10(2)8-13-3/h10,13H,6-9H2,1-5H3
InChIKeyGSJZHUQRLMNAJP-UHFFFAOYSA-N
MW243.35 g/mol
LogP0.17
Rot. Bonds7

About N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide

N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide (PubChem CID 79202204) has the molecular formula C12H25N3O2 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide
PubChem CID79202204
Molecular FormulaC12H25N3O2
Molecular Weight243.35 g/mol
Exact Mass243.19
IUPAC NameN-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide
SMILESCCCN(CC(=O)N(C)C)C(=O)C(C)CNC
InChIInChI=1S/C12H25N3O2/c1-6-7-15(9-11(16)14(4)5)12(17)10(2)8-13-3/h10,13H,6-9H2,1-5H3
InChIKeyGSJZHUQRLMNAJP-UHFFFAOYSA-N
XLogP0.17
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide 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-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide?
The IUPAC name of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide (CID 79202204) is N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide?
The canonical SMILES for N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide is CCCN(CC(=O)N(C)C)C(=O)C(C)CNC.
What is the InChIKey of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide?
The InChIKey is GSJZHUQRLMNAJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O2/c1-6-7-15(9-11(16)14(4)5)12(17)10(2)8-13-3/h10,13H,6-9H2,1-5H3.
What are the key properties of N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide?
N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide has a molecular weight of 243.35 g/mol, XLogP of 0.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-oxoethyl]-2-methyl-3-(methylamino)-N-propylpropanamide is sourced from PubChem (CID 79202204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).