4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one

C8H11N5O — CID 79961898

IUPAC4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one
SMILESCc1c(C2NC(=O)N=C2N)cnn1C
InChIInChI=1S/C8H11N5O/c1-4-5(3-10-13(4)2)6-7(9)12-8(14)11-6/h3,6H,1-2H3,(H3,9,11,12,14)
InChIKeyGGCWRKGUDWYHOI-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.15
Rot. Bonds1

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

4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one (PubChem CID 79961898) has the molecular formula C8H11N5O and a molecular weight of 193.21 g/mol. Its IUPAC name is 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one
PubChem CID79961898
Molecular FormulaC8H11N5O
Molecular Weight193.21 g/mol
Exact Mass193.10
IUPAC Name4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one
SMILESCc1c(C2NC(=O)N=C2N)cnn1C
InChIInChI=1S/C8H11N5O/c1-4-5(3-10-13(4)2)6-7(9)12-8(14)11-6/h3,6H,1-2H3,(H3,9,11,12,14)
InChIKeyGGCWRKGUDWYHOI-UHFFFAOYSA-N
XLogP-0.15
TPSA85.30 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one (CID 79961898) is 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one is Cc1c(C2NC(=O)N=C2N)cnn1C.
What is the InChIKey of 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one?
The InChIKey is GGCWRKGUDWYHOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5O/c1-4-5(3-10-13(4)2)6-7(9)12-8(14)11-6/h3,6H,1-2H3,(H3,9,11,12,14).
What are the key properties of 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one?
4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one has a molecular weight of 193.21 g/mol, XLogP of -0.15, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(1,5-dimethylpyrazol-4-yl)-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 79961898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).