5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one

C11H17N5O2 — CID 79967010

IUPAC5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one
SMILESCOCCN1C(=O)N=C(N)C1c1cnn(C)c1C
InChIInChI=1S/C11H17N5O2/c1-7-8(6-13-15(7)2)9-10(12)14-11(17)16(9)4-5-18-3/h6,9H,4-5H2,1-3H3,(H2,12,14,17)
InChIKeyWRGMEJDSKBGUDB-UHFFFAOYSA-N
MW251.29 g/mol
LogP0.21
Rot. Bonds4

About 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one

5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one (PubChem CID 79967010) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one
PubChem CID79967010
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one
SMILESCOCCN1C(=O)N=C(N)C1c1cnn(C)c1C
InChIInChI=1S/C11H17N5O2/c1-7-8(6-13-15(7)2)9-10(12)14-11(17)16(9)4-5-18-3/h6,9H,4-5H2,1-3H3,(H2,12,14,17)
InChIKeyWRGMEJDSKBGUDB-UHFFFAOYSA-N
XLogP0.21
TPSA85.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-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

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one?
The IUPAC name of 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one (CID 79967010) is 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one?
The canonical SMILES for 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one is COCCN1C(=O)N=C(N)C1c1cnn(C)c1C.
What is the InChIKey of 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one?
The InChIKey is WRGMEJDSKBGUDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-7-8(6-13-15(7)2)9-10(12)14-11(17)16(9)4-5-18-3/h6,9H,4-5H2,1-3H3,(H2,12,14,17).
What are the key properties of 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one?
5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one has a molecular weight of 251.29 g/mol, XLogP of 0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(1,5-dimethylpyrazol-4-yl)-3-(2-methoxyethyl)-4H-imidazol-2-one is sourced from PubChem (CID 79967010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).