2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

C16H22N4O2 — CID 154768732

IUPAC2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILES[H]/N=C1\N(C)CC(=O)N1CC(=O)Nc1c(C)cccc1C(C)C
InChIInChI=1S/C16H22N4O2/c1-10(2)12-7-5-6-11(3)15(12)18-13(21)8-20-14(22)9-19(4)16(20)17/h5-7,10,17H,8-9H2,1-4H3,(H,18,21)/b17-16+
InChIKeyOAQLMFFMSAOKJT-WUKNDPDISA-N
MW302.38 g/mol
LogP1.77
Rot. Bonds4

About 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide

2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (PubChem CID 154768732) has the molecular formula C16H22N4O2 and a molecular weight of 302.38 g/mol. Its IUPAC name is 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
PubChem CID154768732
Molecular FormulaC16H22N4O2
Molecular Weight302.38 g/mol
Exact Mass302.17
IUPAC Name2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
SMILES[H]/N=C1\N(C)CC(=O)N1CC(=O)Nc1c(C)cccc1C(C)C
InChIInChI=1S/C16H22N4O2/c1-10(2)12-7-5-6-11(3)15(12)18-13(21)8-20-14(22)9-19(4)16(20)17/h5-7,10,17H,8-9H2,1-4H3,(H,18,21)/b17-16+
InChIKeyOAQLMFFMSAOKJT-WUKNDPDISA-N
XLogP1.77
TPSA76.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.38
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide 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

2-(2,5-dioxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 110686764
2-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 23410212
2-(4-acetylpiperazin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 8904334
2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 40696125
2-[4-(2-methylphenyl)piperazin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 8726239
2-[(3aR,5S,6S,7aS)-5,6-dihydroxy-1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 91829375
2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 8930637
N-(2-methyl-6-propan-2-ylphenyl)-2-sulfanylacetamide
CID 715390
2-(methylamino)-N-(2-methyl-6-propan-2-ylphenyl)acetamide;hydrochloride
CID 119674500
2-[(4S)-4-(2,3-dihydro-1H-inden-5-yl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 7884396
2-(5-amino-2-oxo-1-pyridinyl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 82031682
N-(2-methyl-6-propan-2-ylphenyl)-2-(3-oxo-1,2-benzothiazol-2-yl)acetamide
CID 2496717

Frequently Asked Questions

What is the IUPAC name of 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide (CID 154768732) is 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is [H]/N=C1\N(C)CC(=O)N1CC(=O)Nc1c(C)cccc1C(C)C.
What is the InChIKey of 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
The InChIKey is OAQLMFFMSAOKJT-WUKNDPDISA-N. The full InChI is InChI=1S/C16H22N4O2/c1-10(2)12-7-5-6-11(3)15(12)18-13(21)8-20-14(22)9-19(4)16(20)17/h5-7,10,17H,8-9H2,1-4H3,(H,18,21)/b17-16+.
What are the key properties of 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide?
2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide has a molecular weight of 302.38 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-imino-3-methyl-5-oxoimidazolidin-1-yl)-N-(2-methyl-6-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 154768732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).