4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one

C11H14N4O — CID 79962105

IUPAC4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one
SMILESCN(C)c1ccc(C2NC(=O)N=C2N)cc1
InChIInChI=1S/C11H14N4O/c1-15(2)8-5-3-7(4-6-8)9-10(12)14-11(16)13-9/h3-6,9H,1-2H3,(H3,12,13,14,16)
InChIKeyNBHVKWACOPBBNJ-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.87
Rot. Bonds2

About 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one

4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one (PubChem CID 79962105) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one
PubChem CID79962105
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one
SMILESCN(C)c1ccc(C2NC(=O)N=C2N)cc1
InChIInChI=1S/C11H14N4O/c1-15(2)8-5-3-7(4-6-8)9-10(12)14-11(16)13-9/h3-6,9H,1-2H3,(H3,12,13,14,16)
InChIKeyNBHVKWACOPBBNJ-UHFFFAOYSA-N
XLogP0.87
TPSA70.72 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one?
The IUPAC name of 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one (CID 79962105) is 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one.
What is the SMILES notation for 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one?
The canonical SMILES for 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one is CN(C)c1ccc(C2NC(=O)N=C2N)cc1.
What is the InChIKey of 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one?
The InChIKey is NBHVKWACOPBBNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-15(2)8-5-3-7(4-6-8)9-10(12)14-11(16)13-9/h3-6,9H,1-2H3,(H3,12,13,14,16).
What are the key properties of 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one?
4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one has a molecular weight of 218.26 g/mol, XLogP of 0.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-[4-(dimethylamino)phenyl]-1,5-dihydroimidazol-2-one is sourced from PubChem (CID 79962105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).