4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one

C9H9N3O2 — CID 91092935

IUPAC4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one
SMILESNC1=NC(c2ccc(O)cc2)NC1=O
InChIInChI=1S/C9H9N3O2/c10-7-9(14)12-8(11-7)5-1-3-6(13)4-2-5/h1-4,8,13H,(H2,10,11)(H,12,14)
InChIKeyJKTYQOICRVTWGC-UHFFFAOYSA-N
MW191.19 g/mol
LogP-0.12
Rot. Bonds1

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

4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one (PubChem CID 91092935) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one.

Molecular Properties

Compound Name4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one
PubChem CID91092935
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one
SMILESNC1=NC(c2ccc(O)cc2)NC1=O
InChIInChI=1S/C9H9N3O2/c10-7-9(14)12-8(11-7)5-1-3-6(13)4-2-5/h1-4,8,13H,(H2,10,11)(H,12,14)
InChIKeyJKTYQOICRVTWGC-UHFFFAOYSA-N
XLogP-0.12
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 5-0.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-hydroxyphenyl)methyl]acetamide
CID 458498
4-(4,5-Dihydro-1H-imidazol-2-yl)phenol
CID 135417369
1-[(4-Hydroxyphenyl)methyl]-1-methylurea
CID 61044600
2-[4-Hydroxybenzylamino]propanamide
CID 43402311
1,3-Bis[(4-hydroxyphenyl)methyl]urea
CID 85523861
1-(2-Fluoroethyl)-3-[(4-hydroxyphenyl)methyl]urea
CID 25119496
(S)-2-((4-Hydroxybenzyl)amino)propanamide
CID 54323013
Acetamide, 2,2,2-trifluoro-N-[(4-hydroxyphenyl)methyl]-
CID 57656322
5,5-Difluoro-1-[(4-hydroxyphenyl)methyl]imidazolidin-2-one
CID 169238718
2-fluoro-N-[(4-hydroxyphenyl)methyl]acetamide
CID 172744538
(2R)-2-amino-5-(diaminomethylideneamino)-N-[(2,6-difluoro-4-hydroxyphenyl)methyl]pentanamide
CID 176814262
(2R)-2-amino-5-[[amino-(ethylcarbamoylamino)methylidene]amino]-N-[(2,6-difluoro-4-hydroxyphenyl)methyl]pentanamide
CID 176814321

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one?
The IUPAC name of 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one (CID 91092935) is 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one.
What is the SMILES notation for 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one?
The canonical SMILES for 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one is NC1=NC(c2ccc(O)cc2)NC1=O.
What is the InChIKey of 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one?
The InChIKey is JKTYQOICRVTWGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c10-7-9(14)12-8(11-7)5-1-3-6(13)4-2-5/h1-4,8,13H,(H2,10,11)(H,12,14).
What are the key properties of 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one?
4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one has a molecular weight of 191.19 g/mol, XLogP of -0.12, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(4-hydroxyphenyl)-1,2-dihydroimidazol-5-one is sourced from PubChem (CID 91092935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).