methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol

C10H14N4O — CID 143618555

IUPACmethanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol
SMILESCN1CC(CO)=Nc2ncccc21.[H]N=C
InChIInChI=1S/C9H11N3O.CH3N/c1-12-5-7(6-13)11-9-8(12)3-2-4-10-9;1-2/h2-4,13H,5-6H2,1H3;2H,1H2
InChIKeyBGWKXXLPUVVJTQ-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.86
Rot. Bonds1

About methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol

methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol (PubChem CID 143618555) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol.

Molecular Properties

Compound Namemethanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol
PubChem CID143618555
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Namemethanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol
SMILESCN1CC(CO)=Nc2ncccc21.[H]N=C
InChIInChI=1S/C9H11N3O.CH3N/c1-12-5-7(6-13)11-9-8(12)3-2-4-10-9;1-2/h2-4,13H,5-6H2,1H3;2H,1H2
InChIKeyBGWKXXLPUVVJTQ-UHFFFAOYSA-N
XLogP0.86
TPSA72.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol?
The IUPAC name of methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol (CID 143618555) is methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol.
What is the SMILES notation for methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol?
The canonical SMILES for methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol is CN1CC(CO)=Nc2ncccc21.[H]N=C.
What is the InChIKey of methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol?
The InChIKey is BGWKXXLPUVVJTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O.CH3N/c1-12-5-7(6-13)11-9-8(12)3-2-4-10-9;1-2/h2-4,13H,5-6H2,1H3;2H,1H2.
What are the key properties of methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol?
methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol has a molecular weight of 206.25 g/mol, XLogP of 0.86, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methanimine;(1-methyl-2H-pyrido[2,3-b]pyrazin-3-yl)methanol is sourced from PubChem (CID 143618555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).