3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one

C16H19N3O2 — CID 119048638

IUPAC3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one
SMILESCCN1CN(C(=O)Cc2c[nH]c3cc(C)ccc23)CC1=O
InChIInChI=1S/C16H19N3O2/c1-3-18-10-19(9-16(18)21)15(20)7-12-8-17-14-6-11(2)4-5-13(12)14/h4-6,8,17H,3,7,9-10H2,1-2H3
InChIKeyJNSUABQCSMRISY-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.67
Rot. Bonds3

About 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one

3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one (PubChem CID 119048638) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one.

Molecular Properties

Compound Name3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one
PubChem CID119048638
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one
SMILESCCN1CN(C(=O)Cc2c[nH]c3cc(C)ccc23)CC1=O
InChIInChI=1S/C16H19N3O2/c1-3-18-10-19(9-16(18)21)15(20)7-12-8-17-14-6-11(2)4-5-13(12)14/h4-6,8,17H,3,7,9-10H2,1-2H3
InChIKeyJNSUABQCSMRISY-UHFFFAOYSA-N
XLogP1.67
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one 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 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one?
The IUPAC name of 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one (CID 119048638) is 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one.
What is the SMILES notation for 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one?
The canonical SMILES for 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one is CCN1CN(C(=O)Cc2c[nH]c3cc(C)ccc23)CC1=O.
What is the InChIKey of 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one?
The InChIKey is JNSUABQCSMRISY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-3-18-10-19(9-16(18)21)15(20)7-12-8-17-14-6-11(2)4-5-13(12)14/h4-6,8,17H,3,7,9-10H2,1-2H3.
What are the key properties of 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one?
3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one has a molecular weight of 285.35 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-[2-(6-methyl-1H-indol-3-yl)acetyl]imidazolidin-4-one is sourced from PubChem (CID 119048638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).