3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione

C15H12ClN3O2 — CID 60835954

IUPAC3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione
SMILESNc1cccc(N2C(=O)CN(c3cccc(Cl)c3)C2=O)c1
InChIInChI=1S/C15H12ClN3O2/c16-10-3-1-5-12(7-10)18-9-14(20)19(15(18)21)13-6-2-4-11(17)8-13/h1-8H,9,17H2
InChIKeyNFWSNQNZHYMLMG-UHFFFAOYSA-N
MW301.73 g/mol
LogP2.90
Rot. Bonds2

About 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione

3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione (PubChem CID 60835954) has the molecular formula C15H12ClN3O2 and a molecular weight of 301.73 g/mol. Its IUPAC name is 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione
PubChem CID60835954
Molecular FormulaC15H12ClN3O2
Molecular Weight301.73 g/mol
Exact Mass301.06
IUPAC Name3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione
SMILESNc1cccc(N2C(=O)CN(c3cccc(Cl)c3)C2=O)c1
InChIInChI=1S/C15H12ClN3O2/c16-10-3-1-5-12(7-10)18-9-14(20)19(15(18)21)13-6-2-4-11(17)8-13/h1-8H,9,17H2
InChIKeyNFWSNQNZHYMLMG-UHFFFAOYSA-N
XLogP2.90
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.73
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(3-chlorophenyl)-1-cyclopropylimidazolidine-2,4-dione
CID 54924311
3-(3-chlorophenyl)-1-prop-2-enylimidazolidine-2,4-dione
CID 79285648
3-(3-fluorophenyl)-1-phenylimidazolidine-2,4-dione
CID 61030217
1-(3-aminophenyl)-4-methyl-3H-quinoxalin-2-one
CID 117030723
6-amino-2-(3-chlorophenyl)-3H-isoindol-1-one
CID 82165712
3-(3-methylphenyl)-1-(4-methylphenyl)imidazolidine-2,4-dione
CID 60837913
3-(3-chlorophenyl)-1-methyl-2-sulfanylideneimidazolidin-4-one
CID 97455638
1-(3-aminophenyl)piperazine-2,5-dione
CID 82512416
1-(3-aminophenyl)-3,4-dihydroquinoxalin-2-one
CID 117030560
1-(3-aminophenyl)-4-chloropyrrolidin-2-one
CID 168689822
3-[2,5-dioxo-3-[3-(trifluoromethyl)phenyl]imidazolidin-1-yl]benzoic acid
CID 10384140
5-(3-aminophenoxy)-2-(3-chlorophenyl)isoindole-1,3-dione
CID 2230936

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione (CID 60835954) is 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione is Nc1cccc(N2C(=O)CN(c3cccc(Cl)c3)C2=O)c1.
What is the InChIKey of 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione?
The InChIKey is NFWSNQNZHYMLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O2/c16-10-3-1-5-12(7-10)18-9-14(20)19(15(18)21)13-6-2-4-11(17)8-13/h1-8H,9,17H2.
What are the key properties of 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione?
3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione has a molecular weight of 301.73 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminophenyl)-1-(3-chlorophenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 60835954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).