4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one

C10H11N3O — CID 79961557

IUPAC4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one
SMILESCc1ccc(C2NC(=O)N=C2N)cc1
InChIInChI=1S/C10H11N3O/c1-6-2-4-7(5-3-6)8-9(11)13-10(14)12-8/h2-5,8H,1H3,(H3,11,12,13,14)
InChIKeyGWQCSIXFXKTKBO-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.12
Rot. Bonds1

About 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one

4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one (PubChem CID 79961557) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one
PubChem CID79961557
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one
SMILESCc1ccc(C2NC(=O)N=C2N)cc1
InChIInChI=1S/C10H11N3O/c1-6-2-4-7(5-3-6)8-9(11)13-10(14)12-8/h2-5,8H,1H3,(H3,11,12,13,14)
InChIKeyGWQCSIXFXKTKBO-UHFFFAOYSA-N
XLogP1.12
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one
CID 79962105
4-amino-5-(2-methylphenyl)-1,5-dihydroimidazol-2-one
CID 79960820
4-amino-5-(3-fluorophenyl)-1,5-dihydroimidazol-2-one
CID 79961894
4-amino-5-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-1,5-dihydroimidazol-2-one
CID 79960436
6-methyl-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxamide
CID 23881832
6-(4-methylphenyl)-2-oxo-5,6-dihydro-1H-pyrimidine-4-carboxylic acid
CID 170923694
4,5-bis(4-methylphenyl)-1,5-dihydroimidazole-2-thione
CID 25220246
5-(4-methylphenyl)-1-oxo-1,2-thiazolidin-3-one
CID 67121813
6,9-diamino-3,5,10,12-tetrazatricyclo[6.4.0.02,7]dodeca-5,9-diene-4,11-dione
CID 118987303
3-methyl-4-(4-methylphenyl)-1,4-dihydropyrazol-5-one
CID 604685
3-(2-aminoethyl)-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 82147805
1-methyl-4-[(1R,2R)-2-(4-methylphenyl)cyclobutyl]benzene
CID 15556691

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one (CID 79961557) is 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one is Cc1ccc(C2NC(=O)N=C2N)cc1.
What is the InChIKey of 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one?
The InChIKey is GWQCSIXFXKTKBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-6-2-4-7(5-3-6)8-9(11)13-10(14)12-8/h2-5,8H,1H3,(H3,11,12,13,14).
What are the key properties of 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one?
4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one has a molecular weight of 189.22 g/mol, XLogP of 1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(4-methylphenyl)-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 79961557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).