N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide

C10H15N3O2 — CID 23356763

IUPACN-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide
SMILESCCC(=O)NC(=O)Cn1cnc(C)c1C
InChIInChI=1S/C10H15N3O2/c1-4-9(14)12-10(15)5-13-6-11-7(2)8(13)3/h6H,4-5H2,1-3H3,(H,12,14,15)
InChIKeyOUYIPZURBPLIBK-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.55
Rot. Bonds3

About N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide

N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide (PubChem CID 23356763) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide.

Molecular Properties

Compound NameN-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide
PubChem CID23356763
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide
SMILESCCC(=O)NC(=O)Cn1cnc(C)c1C
InChIInChI=1S/C10H15N3O2/c1-4-9(14)12-10(15)5-13-6-11-7(2)8(13)3/h6H,4-5H2,1-3H3,(H,12,14,15)
InChIKeyOUYIPZURBPLIBK-UHFFFAOYSA-N
XLogP0.55
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide with MolForge

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

Launch Full Analysis

Related Compounds

(2S)-2-acetamido-N-[2-(4,5-dimethylimidazol-1-yl)ethyl]pentanamide
CID 100066644
1-[3-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)propyl]imidazole-4,5-dicarbonitrile
CID 132377713
2-[5-(aminomethyl)-4-methylimidazol-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 53685528
N-(1-(4,5-dicyano-1H-imidazol-1-yl)-1-oxopropan-2-yl)acetamide
CID 154585660
2-(4,5-dimethylimidazol-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)acetamide
CID 56789699
2-(4,5-dimethylimidazol-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 115616733
1-(4,5-Dimethyl-1H-imidazol-1-yl)ethan-1-one
CID 12415055
1-(4,5-dimethyl-1H-imidazol-1-yl)propan-2-one
CID 18741006
N-[5-(4,5-dimethylimidazol-1-yl)pent-3-yn-2-yl]-N-methylacetamide
CID 19902294
4-(4,5-dimethylimidazol-1-yl)-N,N-dipropylbutanamide
CID 19964902
2-(4,5-dimethylimidazol-1-yl)-N,N-dipropylacetamide
CID 19964980
3-(4,5-dimethylimidazol-1-yl)-N,N-dipropylpropanamide
CID 19964982

Frequently Asked Questions

What is the IUPAC name of N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide?
The IUPAC name of N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide (CID 23356763) is N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide.
What is the SMILES notation for N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide?
The canonical SMILES for N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide is CCC(=O)NC(=O)Cn1cnc(C)c1C.
What is the InChIKey of N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide?
The InChIKey is OUYIPZURBPLIBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-4-9(14)12-10(15)5-13-6-11-7(2)8(13)3/h6H,4-5H2,1-3H3,(H,12,14,15).
What are the key properties of N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide?
N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide has a molecular weight of 209.25 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4,5-dimethylimidazol-1-yl)acetyl]propanamide is sourced from PubChem (CID 23356763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).