(9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide

C10H13N5O2 — CID 13218245

IUPAC(9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC1CC/C(=N\N)c2ncc(C(N)=O)c(=O)n21
InChIInChI=1S/C10H13N5O2/c1-5-2-3-7(14-12)9-13-4-6(8(11)16)10(17)15(5)9/h4-5H,2-3,12H2,1H3,(H2,11,16)/b14-7+
InChIKeyXAJITVUQTCAQRH-VGOFMYFVSA-N
MW235.25 g/mol
LogP-0.64
Rot. Bonds1

About (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide

(9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide (PubChem CID 13218245) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name(9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide
PubChem CID13218245
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC Name(9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide
SMILESCC1CC/C(=N\N)c2ncc(C(N)=O)c(=O)n21
InChIInChI=1S/C10H13N5O2/c1-5-2-3-7(14-12)9-13-4-6(8(11)16)10(17)15(5)9/h4-5H,2-3,12H2,1H3,(H2,11,16)/b14-7+
InChIKeyXAJITVUQTCAQRH-VGOFMYFVSA-N
XLogP-0.64
TPSA116.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 5-0.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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'}

Analyze (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide?
The IUPAC name of (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide (CID 13218245) is (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide.
What is the SMILES notation for (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide?
The canonical SMILES for (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide is CC1CC/C(=N\N)c2ncc(C(N)=O)c(=O)n21.
What is the InChIKey of (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide?
The InChIKey is XAJITVUQTCAQRH-VGOFMYFVSA-N. The full InChI is InChI=1S/C10H13N5O2/c1-5-2-3-7(14-12)9-13-4-6(8(11)16)10(17)15(5)9/h4-5H,2-3,12H2,1H3,(H2,11,16)/b14-7+.
What are the key properties of (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide?
(9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide has a molecular weight of 235.25 g/mol, XLogP of -0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (9E)-9-hydrazinylidene-6-methyl-4-oxo-7,8-dihydro-6H-pyrido[1,2-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 13218245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).