2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium

C10H9N2Y- — CID 58148024

IUPAC2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium
SMILESC=C1[C-]=C(C)N=C2C=CC=CN12.[Y]
InChIInChI=1S/C10H9N2.Y/c1-8-7-9(2)12-6-4-3-5-10(12)11-8;/h3-6H,2H2,1H3;/q-1;
InChIKeyALYWPMCLDXZFEU-UHFFFAOYSA-N
MW246.10 g/mol
LogP2.00
Rot. Bonds

About 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium

2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium (PubChem CID 58148024) has the molecular formula C10H9N2Y- and a molecular weight of 246.10 g/mol. Its IUPAC name is 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium.

Molecular Properties

Compound Name2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium
PubChem CID58148024
Molecular FormulaC10H9N2Y-
Molecular Weight246.10 g/mol
Exact Mass245.98
IUPAC Name2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium
SMILESC=C1[C-]=C(C)N=C2C=CC=CN12.[Y]
InChIInChI=1S/C10H9N2.Y/c1-8-7-9(2)12-6-4-3-5-10(12)11-8;/h3-6H,2H2,1H3;/q-1;
InChIKeyALYWPMCLDXZFEU-UHFFFAOYSA-N
XLogP2.00
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.10
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

2-Methyl-4H-pyrido[1,2-a]pyrimidine-4-thione
CID 600595
2,6,13-Triazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
CID 12404659
Pyrido[1,2-a]pyrimidine
CID 20094215
2h-Pyrido-[1,2-a]pyrimidine
CID 20222720
3,4-Dihydro-2h-pyrido[1,2-a]pyrimidine
CID 21111582
4-Methyl-4h-pyrido[1,2-a]pyrimidine
CID 129791993
Iminoquinolizine
CID 129799109
2,13-Diazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
CID 135082283
Aminopyrido[1,2-a]pyrimidine
CID 138376774
4-methyl-2,2-bis(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine
CID 5226153
2-ethynyl-7-fluoro-4H-pyrido[1,2-a]pyrimidine
CID 152485585
4-fluoro-N-methyl-1-prop-1-en-2-ylpyridin-2-imine
CID 156652493

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium?
The IUPAC name of 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium (CID 58148024) is 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium.
What is the SMILES notation for 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium?
The canonical SMILES for 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium is C=C1[C-]=C(C)N=C2C=CC=CN12.[Y].
What is the InChIKey of 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium?
The InChIKey is ALYWPMCLDXZFEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N2.Y/c1-8-7-9(2)12-6-4-3-5-10(12)11-8;/h3-6H,2H2,1H3;/q-1;.
What are the key properties of 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium?
2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium has a molecular weight of 246.10 g/mol, XLogP of 2.00, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-methylidene-3H-pyrido[1,2-a]pyrimidin-3-ide;yttrium is sourced from PubChem (CID 58148024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).