5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one

C14H17N3O3 — CID 79961193

IUPAC5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one
SMILESCOc1ccc(C2C(N)=NC(=O)N2C2CC2)c(OC)c1
InChIInChI=1S/C14H17N3O3/c1-19-9-5-6-10(11(7-9)20-2)12-13(15)16-14(18)17(12)8-3-4-8/h5-8,12H,3-4H2,1-2H3,(H2,15,16,18)
InChIKeyYYSMLORSVHHYPR-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.70
Rot. Bonds4

About 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one

5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one (PubChem CID 79961193) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one
PubChem CID79961193
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one
SMILESCOc1ccc(C2C(N)=NC(=O)N2C2CC2)c(OC)c1
InChIInChI=1S/C14H17N3O3/c1-19-9-5-6-10(11(7-9)20-2)12-13(15)16-14(18)17(12)8-3-4-8/h5-8,12H,3-4H2,1-2H3,(H2,15,16,18)
InChIKeyYYSMLORSVHHYPR-UHFFFAOYSA-N
XLogP1.70
TPSA77.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-3-cyclopropyl-4-(4-methoxyphenyl)-4H-imidazol-2-one
CID 79960655
5-amino-3-(cyclopropylmethyl)-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one
CID 79971673
5-amino-3-cyclopropyl-4-(3,5-dimethoxyphenyl)-4H-imidazol-2-one
CID 79961404
5-amino-4-(2,4-dimethoxyphenyl)-3-(2-methylpropyl)-4H-imidazol-2-one
CID 79959429
5-amino-4-(2,5-dimethoxyphenyl)-3-propan-2-yl-4H-imidazol-2-one
CID 79967027
5-amino-3-cyclopropyl-4-[4-(difluoromethoxy)phenyl]-4H-imidazol-2-one
CID 79961761
5-amino-4-(2-bromo-4-methoxyphenyl)-3-ethyl-4H-imidazol-2-one
CID 112749216
5-amino-3-but-3-yn-2-yl-4-(2,5-dimethoxyphenyl)-4H-imidazol-2-one
CID 114420980
5-cyclopentyl-4-(2,4-dimethoxyphenyl)-3-(4-methylphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one
CID 43856433
5-amino-4-(3-methoxyphenyl)-3-propan-2-yl-4H-imidazol-2-one
CID 79967392
5-amino-6-(2,4-dimethoxyphenyl)piperidin-2-one
CID 64541230
5-amino-4-(2,3-dimethoxyphenyl)-3-methyl-4H-imidazol-2-one
CID 79959271

Frequently Asked Questions

What is the IUPAC name of 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one?
The IUPAC name of 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one (CID 79961193) is 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one?
The canonical SMILES for 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one is COc1ccc(C2C(N)=NC(=O)N2C2CC2)c(OC)c1.
What is the InChIKey of 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one?
The InChIKey is YYSMLORSVHHYPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c1-19-9-5-6-10(11(7-9)20-2)12-13(15)16-14(18)17(12)8-3-4-8/h5-8,12H,3-4H2,1-2H3,(H2,15,16,18).
What are the key properties of 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one?
5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one has a molecular weight of 275.31 g/mol, XLogP of 1.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-cyclopropyl-4-(2,4-dimethoxyphenyl)-4H-imidazol-2-one is sourced from PubChem (CID 79961193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).