(4-aminophenyl)-imidazolidin-1-ylmethanone;ethane

C12H19N3O — CID 153387560

IUPAC(4-aminophenyl)-imidazolidin-1-ylmethanone;ethane
SMILESCC.Nc1ccc(C(=O)N2CCNC2)cc1
InChIInChI=1S/C10H13N3O.C2H6/c11-9-3-1-8(2-4-9)10(14)13-6-5-12-7-13;1-2/h1-4,12H,5-7,11H2;1-2H3
InChIKeyAMJXCNXIEUUWDP-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.30
Rot. Bonds1

About (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane

(4-aminophenyl)-imidazolidin-1-ylmethanone;ethane (PubChem CID 153387560) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane.

Molecular Properties

Compound Name(4-aminophenyl)-imidazolidin-1-ylmethanone;ethane
PubChem CID153387560
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name(4-aminophenyl)-imidazolidin-1-ylmethanone;ethane
SMILESCC.Nc1ccc(C(=O)N2CCNC2)cc1
InChIInChI=1S/C10H13N3O.C2H6/c11-9-3-1-8(2-4-9)10(14)13-6-5-12-7-13;1-2/h1-4,12H,5-7,11H2;1-2H3
InChIKeyAMJXCNXIEUUWDP-UHFFFAOYSA-N
XLogP1.30
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane 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 (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane?
The IUPAC name of (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane (CID 153387560) is (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane.
What is the SMILES notation for (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane?
The canonical SMILES for (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane is CC.Nc1ccc(C(=O)N2CCNC2)cc1.
What is the InChIKey of (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane?
The InChIKey is AMJXCNXIEUUWDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O.C2H6/c11-9-3-1-8(2-4-9)10(14)13-6-5-12-7-13;1-2/h1-4,12H,5-7,11H2;1-2H3.
What are the key properties of (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane?
(4-aminophenyl)-imidazolidin-1-ylmethanone;ethane has a molecular weight of 221.30 g/mol, XLogP of 1.30, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminophenyl)-imidazolidin-1-ylmethanone;ethane is sourced from PubChem (CID 153387560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).