N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide

C13H18N4O2 — CID 62490458

IUPACN-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
SMILESCN1CCN(CC(=O)N(C)c2ccc(N)cc2)C1=O
InChIInChI=1S/C13H18N4O2/c1-15-7-8-17(13(15)19)9-12(18)16(2)11-5-3-10(14)4-6-11/h3-6H,7-9,14H2,1-2H3
InChIKeyPEQKTSJDROWGLT-UHFFFAOYSA-N
MW262.31 g/mol
LogP0.60
Rot. Bonds3

About N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide

N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide (PubChem CID 62490458) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
PubChem CID62490458
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC NameN-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
SMILESCN1CCN(CC(=O)N(C)c2ccc(N)cc2)C1=O
InChIInChI=1S/C13H18N4O2/c1-15-7-8-17(13(15)19)9-12(18)16(2)11-5-3-10(14)4-6-11/h3-6H,7-9,14H2,1-2H3
InChIKeyPEQKTSJDROWGLT-UHFFFAOYSA-N
XLogP0.60
TPSA69.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(4-aminophenyl)-N-methyl-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 43376263
N-(4-aminophenyl)-N-methyl-2-(3-oxomorpholin-4-yl)acetamide
CID 79468372
N-(4-aminophenyl)-N-methyl-2-piperidin-1-ylacetamide
CID 22569644
N-(4-aminophenyl)-2-(4-ethylpiperazin-1-yl)-N-methylacetamide
CID 43375589
N-(4-aminophenyl)-2-(4-cyclopropylpiperazin-1-yl)-N-methylacetamide
CID 61440037
N-(4-aminophenyl)-2-(2,6-dimethylpiperidin-1-yl)-N-methylacetamide
CID 43375666
N-(4-aminophenyl)-N-methyl-3-(4-methylpiperazin-1-yl)propanamide
CID 69059607
N-(4-aminophenyl)-2-[3-(2-hydroxyethyl)pyrrolidin-1-yl]-N-methylacetamide
CID 114797175
N-(4-aminophenyl)-N-methyl-2-(5-oxo-1,4-diazepan-1-yl)acetamide
CID 63003549
N-(4-aminophenyl)-2-[3-(methoxymethyl)piperidin-1-yl]-N-methylacetamide
CID 106585961
N-(4-aminophenyl)-2-[3-(cyclohexylmethyl)piperidin-1-yl]-N-methylacetamide
CID 154490639
N-(4-aminophenyl)-N-methyl-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62961589

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide (CID 62490458) is N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide is CN1CCN(CC(=O)N(C)c2ccc(N)cc2)C1=O.
What is the InChIKey of N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
The InChIKey is PEQKTSJDROWGLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c1-15-7-8-17(13(15)19)9-12(18)16(2)11-5-3-10(14)4-6-11/h3-6H,7-9,14H2,1-2H3.
What are the key properties of N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide has a molecular weight of 262.31 g/mol, XLogP of 0.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N-methyl-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 62490458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).