4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one

C17H17N3O2 — CID 175538860

IUPAC4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(C(O)CNc2ccccc2-c2ccccc2)[nH]1
InChIInChI=1S/C17H17N3O2/c21-16(15-10-19-17(22)20-15)11-18-14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-10,16,18,21H,11H2,(H2,19,20,22)
InChIKeyNPBGLWPRPHONFA-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.52
Rot. Bonds5

About 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one

4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one (PubChem CID 175538860) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one
PubChem CID175538860
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(C(O)CNc2ccccc2-c2ccccc2)[nH]1
InChIInChI=1S/C17H17N3O2/c21-16(15-10-19-17(22)20-15)11-18-14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-10,16,18,21H,11H2,(H2,19,20,22)
InChIKeyNPBGLWPRPHONFA-UHFFFAOYSA-N
XLogP2.52
TPSA80.91 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.52
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one (CID 175538860) is 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one is O=c1[nH]cc(C(O)CNc2ccccc2-c2ccccc2)[nH]1.
What is the InChIKey of 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one?
The InChIKey is NPBGLWPRPHONFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c21-16(15-10-19-17(22)20-15)11-18-14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-10,16,18,21H,11H2,(H2,19,20,22).
What are the key properties of 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one?
4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one has a molecular weight of 295.34 g/mol, XLogP of 2.52, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-hydroxy-2-(2-phenylanilino)ethyl]-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 175538860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).