2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one

C5H8N4O2 — CID 140994267

IUPAC2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one
SMILESCOc1cnc(NN)[nH]c1=O
InChIInChI=1S/C5H8N4O2/c1-11-3-2-7-5(9-6)8-4(3)10/h2H,6H2,1H3,(H2,7,8,9,10)
InChIKeyIWDDZXMLGDBYMZ-UHFFFAOYSA-N
MW156.15 g/mol
LogP-0.94
Rot. Bonds2

About 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one

2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one (PubChem CID 140994267) has the molecular formula C5H8N4O2 and a molecular weight of 156.15 g/mol. Its IUPAC name is 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one
PubChem CID140994267
Molecular FormulaC5H8N4O2
Molecular Weight156.15 g/mol
Exact Mass156.06
IUPAC Name2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one
SMILESCOc1cnc(NN)[nH]c1=O
InChIInChI=1S/C5H8N4O2/c1-11-3-2-7-5(9-6)8-4(3)10/h2H,6H2,1H3,(H2,7,8,9,10)
InChIKeyIWDDZXMLGDBYMZ-UHFFFAOYSA-N
XLogP-0.94
TPSA93.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.15
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-amino-5-methoxypyrimidin-4(3H)-one
CID 3288478
2-Nitroamino-5-ethoxypyrimidin-4-one
CID 20186008
2-Nitroamino-5-methoxypyrimidin-4-one
CID 20186014
1-methoxy-2-(5-methoxy-6-oxo-1H-pyrimidin-2-yl)guanidine
CID 90006092
2-hydrazinyl-5-hydroxy-1H-pyrimidin-6-one
CID 140994268
1-methoxy-2-(5-methoxy-6-oxo-1H-pyrimidin-2-yl)guanidine
CID 154045759
(5-methoxy-6-oxo-1H-pyrimidin-2-yl)cyanamide
CID 676430
2-amino-5-propoxy-1H-pyrimidin-6-one
CID 4185659
2-amino-6-methoxy-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CID 130560782
2-Amino-5-ethoxypyrimidin-4(3H)-one
CID 133613672

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one?
The IUPAC name of 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one (CID 140994267) is 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one.
What is the SMILES notation for 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one?
The canonical SMILES for 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one is COc1cnc(NN)[nH]c1=O.
What is the InChIKey of 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one?
The InChIKey is IWDDZXMLGDBYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O2/c1-11-3-2-7-5(9-6)8-4(3)10/h2H,6H2,1H3,(H2,7,8,9,10).
What are the key properties of 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one?
2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one has a molecular weight of 156.15 g/mol, XLogP of -0.94, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-5-methoxy-1H-pyrimidin-6-one is sourced from PubChem (CID 140994267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).