1-(2-aminophenyl)-5-methylimidazolidin-2-one

C10H13N3O — CID 105445057

IUPAC1-(2-aminophenyl)-5-methylimidazolidin-2-one
SMILESCC1CNC(=O)N1c1ccccc1N
InChIInChI=1S/C10H13N3O/c1-7-6-12-10(14)13(7)9-5-3-2-4-8(9)11/h2-5,7H,6,11H2,1H3,(H,12,14)
InChIKeyDYYDJNKPSVFOQH-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.19
Rot. Bonds1

About 1-(2-aminophenyl)-5-methylimidazolidin-2-one

1-(2-aminophenyl)-5-methylimidazolidin-2-one (PubChem CID 105445057) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-(2-aminophenyl)-5-methylimidazolidin-2-one.

Molecular Properties

Compound Name1-(2-aminophenyl)-5-methylimidazolidin-2-one
PubChem CID105445057
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-(2-aminophenyl)-5-methylimidazolidin-2-one
SMILESCC1CNC(=O)N1c1ccccc1N
InChIInChI=1S/C10H13N3O/c1-7-6-12-10(14)13(7)9-5-3-2-4-8(9)11/h2-5,7H,6,11H2,1H3,(H,12,14)
InChIKeyDYYDJNKPSVFOQH-UHFFFAOYSA-N
XLogP1.19
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-aminophenyl)-5-methylimidazolidin-2-one?
The IUPAC name of 1-(2-aminophenyl)-5-methylimidazolidin-2-one (CID 105445057) is 1-(2-aminophenyl)-5-methylimidazolidin-2-one.
What is the SMILES notation for 1-(2-aminophenyl)-5-methylimidazolidin-2-one?
The canonical SMILES for 1-(2-aminophenyl)-5-methylimidazolidin-2-one is CC1CNC(=O)N1c1ccccc1N.
What is the InChIKey of 1-(2-aminophenyl)-5-methylimidazolidin-2-one?
The InChIKey is DYYDJNKPSVFOQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-7-6-12-10(14)13(7)9-5-3-2-4-8(9)11/h2-5,7H,6,11H2,1H3,(H,12,14).
What are the key properties of 1-(2-aminophenyl)-5-methylimidazolidin-2-one?
1-(2-aminophenyl)-5-methylimidazolidin-2-one has a molecular weight of 191.23 g/mol, XLogP of 1.19, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminophenyl)-5-methylimidazolidin-2-one is sourced from PubChem (CID 105445057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).