9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one

C8H10N4O — CID 57038765

IUPAC9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one
SMILESNN=C1CCCn2c1nccc2=O
InChIInChI=1S/C8H10N4O/c9-11-6-2-1-5-12-7(13)3-4-10-8(6)12/h3-4H,1-2,5,9H2
InChIKeyZZJXLVGUQYSGJB-UHFFFAOYSA-N
MW178.20 g/mol
LogP-0.30
Rot. Bonds

About 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one

9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one (PubChem CID 57038765) has the molecular formula C8H10N4O and a molecular weight of 178.20 g/mol. Its IUPAC name is 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one
PubChem CID57038765
Molecular FormulaC8H10N4O
Molecular Weight178.20 g/mol
Exact Mass178.09
IUPAC Name9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one
SMILESNN=C1CCCn2c1nccc2=O
InChIInChI=1S/C8H10N4O/c9-11-6-2-1-5-12-7(13)3-4-10-8(6)12/h3-4H,1-2,5,9H2
InChIKeyZZJXLVGUQYSGJB-UHFFFAOYSA-N
XLogP-0.30
TPSA73.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.20
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one (CID 57038765) is 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one is NN=C1CCCn2c1nccc2=O.
What is the InChIKey of 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is ZZJXLVGUQYSGJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c9-11-6-2-1-5-12-7(13)3-4-10-8(6)12/h3-4H,1-2,5,9H2.
What are the key properties of 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one?
9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 178.20 g/mol, XLogP of -0.30, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydrazinylidene-7,8-dihydro-6H-pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 57038765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).