4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one

C9H9N3O2 — CID 54301190

IUPAC4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(C(O)c2ccccn2)[nH]1
InChIInChI=1S/C9H9N3O2/c13-8(6-3-1-2-4-10-6)7-5-11-9(14)12-7/h1-5,8,13H,(H2,11,12,14)
InChIKeySEHMWDDKONIFEJ-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.18
Rot. Bonds2

About 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one

4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one (PubChem CID 54301190) has the molecular formula C9H9N3O2 and a molecular weight of 191.19 g/mol. Its IUPAC name is 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one.

Molecular Properties

Compound Name4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one
PubChem CID54301190
Molecular FormulaC9H9N3O2
Molecular Weight191.19 g/mol
Exact Mass191.07
IUPAC Name4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one
SMILESO=c1[nH]cc(C(O)c2ccccn2)[nH]1
InChIInChI=1S/C9H9N3O2/c13-8(6-3-1-2-4-10-6)7-5-11-9(14)12-7/h1-5,8,13H,(H2,11,12,14)
InChIKeySEHMWDDKONIFEJ-UHFFFAOYSA-N
XLogP0.18
TPSA81.77 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one?
The IUPAC name of 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one (CID 54301190) is 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one.
What is the SMILES notation for 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one?
The canonical SMILES for 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one is O=c1[nH]cc(C(O)c2ccccn2)[nH]1.
What is the InChIKey of 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one?
The InChIKey is SEHMWDDKONIFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O2/c13-8(6-3-1-2-4-10-6)7-5-11-9(14)12-7/h1-5,8,13H,(H2,11,12,14).
What are the key properties of 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one?
4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one has a molecular weight of 191.19 g/mol, XLogP of 0.18, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[hydroxy(pyridin-2-yl)methyl]-1,3-dihydroimidazol-2-one is sourced from PubChem (CID 54301190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).