2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one

C7H8N4O2 — CID 22618121

IUPAC2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one
SMILESO=c1cc(O)nc(C2=NCCN2)[nH]1
InChIInChI=1S/C7H8N4O2/c12-4-3-5(13)11-7(10-4)6-8-1-2-9-6/h3H,1-2H2,(H,8,9)(H2,10,11,12,13)
InChIKeyDZOPLVRMPIZJRH-UHFFFAOYSA-N
MW180.17 g/mol
LogP-1.17
Rot. Bonds1

About 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one

2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one (PubChem CID 22618121) has the molecular formula C7H8N4O2 and a molecular weight of 180.17 g/mol. Its IUPAC name is 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one
PubChem CID22618121
Molecular FormulaC7H8N4O2
Molecular Weight180.17 g/mol
Exact Mass180.06
IUPAC Name2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one
SMILESO=c1cc(O)nc(C2=NCCN2)[nH]1
InChIInChI=1S/C7H8N4O2/c12-4-3-5(13)11-7(10-4)6-8-1-2-9-6/h3H,1-2H2,(H,8,9)(H2,10,11,12,13)
InChIKeyDZOPLVRMPIZJRH-UHFFFAOYSA-N
XLogP-1.17
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.17
LogP ≤ 5-1.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one?
The IUPAC name of 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one (CID 22618121) is 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one is O=c1cc(O)nc(C2=NCCN2)[nH]1.
What is the InChIKey of 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one?
The InChIKey is DZOPLVRMPIZJRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O2/c12-4-3-5(13)11-7(10-4)6-8-1-2-9-6/h3H,1-2H2,(H,8,9)(H2,10,11,12,13).
What are the key properties of 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one?
2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one has a molecular weight of 180.17 g/mol, XLogP of -1.17, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5-dihydro-1H-imidazol-2-yl)-4-hydroxy-1H-pyrimidin-6-one is sourced from PubChem (CID 22618121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).