5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one

C11H15N5O — CID 79962314

IUPAC5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one
SMILESCc1n[nH]c(C)c1C1C(N)=NC(=O)N1C1CC1
InChIInChI=1S/C11H15N5O/c1-5-8(6(2)15-14-5)9-10(12)13-11(17)16(9)7-3-4-7/h7,9H,3-4H2,1-2H3,(H,14,15)(H2,12,13,17)
InChIKeyAZGDFPNDQNYDMH-UHFFFAOYSA-N
MW233.27 g/mol
LogP1.02
Rot. Bonds2

About 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one

5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one (PubChem CID 79962314) has the molecular formula C11H15N5O and a molecular weight of 233.27 g/mol. Its IUPAC name is 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one.

Molecular Properties

Compound Name5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one
PubChem CID79962314
Molecular FormulaC11H15N5O
Molecular Weight233.27 g/mol
Exact Mass233.13
IUPAC Name5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one
SMILESCc1n[nH]c(C)c1C1C(N)=NC(=O)N1C1CC1
InChIInChI=1S/C11H15N5O/c1-5-8(6(2)15-14-5)9-10(12)13-11(17)16(9)7-3-4-7/h7,9H,3-4H2,1-2H3,(H,14,15)(H2,12,13,17)
InChIKeyAZGDFPNDQNYDMH-UHFFFAOYSA-N
XLogP1.02
TPSA87.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one?
The IUPAC name of 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one (CID 79962314) is 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one.
What is the SMILES notation for 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one?
The canonical SMILES for 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one is Cc1n[nH]c(C)c1C1C(N)=NC(=O)N1C1CC1.
What is the InChIKey of 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one?
The InChIKey is AZGDFPNDQNYDMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-5-8(6(2)15-14-5)9-10(12)13-11(17)16(9)7-3-4-7/h7,9H,3-4H2,1-2H3,(H,14,15)(H2,12,13,17).
What are the key properties of 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one?
5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one has a molecular weight of 233.27 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3-cyclopropyl-4-(3,5-dimethyl-1H-pyrazol-4-yl)-4H-imidazol-2-one is sourced from PubChem (CID 79962314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).