2-hydrazinyl-4-methyl-1H-pyrimidin-6-one

C5H8N4O — CID 135399119

IUPAC2-hydrazinyl-4-methyl-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(NN)n1
InChIInChI=1S/C5H8N4O/c1-3-2-4(10)8-5(7-3)9-6/h2H,6H2,1H3,(H2,7,8,9,10)
InChIKeyRFKCQKWRFAJRPY-UHFFFAOYSA-N
MW140.15 g/mol
LogP-0.64
Rot. Bonds1

About 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one

2-hydrazinyl-4-methyl-1H-pyrimidin-6-one (PubChem CID 135399119) has the molecular formula C5H8N4O and a molecular weight of 140.15 g/mol. Its IUPAC name is 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-hydrazinyl-4-methyl-1H-pyrimidin-6-one
PubChem CID135399119
Molecular FormulaC5H8N4O
Molecular Weight140.15 g/mol
Exact Mass140.07
IUPAC Name2-hydrazinyl-4-methyl-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(NN)n1
InChIInChI=1S/C5H8N4O/c1-3-2-4(10)8-5(7-3)9-6/h2H,6H2,1H3,(H2,7,8,9,10)
InChIKeyRFKCQKWRFAJRPY-UHFFFAOYSA-N
XLogP-0.64
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.15
LogP ≤ 5-0.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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

6-Methyl-2-nitramino-4-pyrimidinol
CID 135428283
2-amino-5-methyl-3H,7H-(1,2,4)triazolo(1,5-a)pyrimidin-7-one
CID 350273
6-methyl-2-(3-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)-4(3H)-pyrimidinone
CID 135464837
6-Ethyl-2-hydrazinyl-4(3H)-pyrimidinone
CID 135876279
N-(7-hydroxy-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)propanamide
CID 930424
2-Hydrazinyl-6-propyl-3,4-dihydropyrimidin-4-one
CID 135762281
N'-(4-hydroxy-6-methylpyrimidin-2-yl)acetohydrazide
CID 135431274
2-Hydrazinyl-5,6-dimethyl-3,4-dihydropyrimidin-4-one
CID 135876280
2-Amino-4-hydroxy-6-hydrazinopyrimidine
CID 135471982
2-[(2E)-2-(Butan-2-ylidene)hydrazin-1-yl]-6-methylpyrimidin-4(1H)-one
CID 135491016
Nsc81230
CID 136187465
2-Hydrazinyl-6-methyl-3,4-dihydropyrimidin-4-one hydrochloride
CID 137231804

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one?
The IUPAC name of 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one (CID 135399119) is 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one is Cc1cc(=O)[nH]c(NN)n1.
What is the InChIKey of 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one?
The InChIKey is RFKCQKWRFAJRPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O/c1-3-2-4(10)8-5(7-3)9-6/h2H,6H2,1H3,(H2,7,8,9,10).
What are the key properties of 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one?
2-hydrazinyl-4-methyl-1H-pyrimidin-6-one has a molecular weight of 140.15 g/mol, XLogP of -0.64, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-4-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 135399119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).