N-methoxy-1,1-dipyridin-2-ylmethanimine

C12H11N3O — CID 59833599

IUPACN-methoxy-1,1-dipyridin-2-ylmethanimine
SMILESCON=C(c1ccccn1)c1ccccn1
InChIInChI=1S/C12H11N3O/c1-16-15-12(10-6-2-4-8-13-10)11-7-3-5-9-14-11/h2-9H,1H3
InChIKeyCTJJKOSKZZJKJP-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.88
Rot. Bonds3

About N-methoxy-1,1-dipyridin-2-ylmethanimine

N-methoxy-1,1-dipyridin-2-ylmethanimine (PubChem CID 59833599) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is N-methoxy-1,1-dipyridin-2-ylmethanimine.

Molecular Properties

Compound NameN-methoxy-1,1-dipyridin-2-ylmethanimine
PubChem CID59833599
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC NameN-methoxy-1,1-dipyridin-2-ylmethanimine
SMILESCON=C(c1ccccn1)c1ccccn1
InChIInChI=1S/C12H11N3O/c1-16-15-12(10-6-2-4-8-13-10)11-7-3-5-9-14-11/h2-9H,1H3
InChIKeyCTJJKOSKZZJKJP-UHFFFAOYSA-N
XLogP1.88
TPSA47.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-methoxy-1-pyridin-2-ylethanimine
CID 87078601
(E)-1-(2-dihydroxyphosphinothioylphenyl)-N-methoxy-1-pyridin-2-ylmethanimine
CID 88719936
N'-trimethylsilyloxypyridine-2-carboximidamide
CID 91699371
(NZ)-N-[phenyl(pyridin-2-yl)methylidene]hydroxylamine
CID 135427108
methyl N-[[phenyl(pyridin-2-yl)methylidene]amino]carbamate
CID 5103078
N-methyl-1-pyridin-2-ylethanimine
CID 12970828
(Z)-1-phenyl-N-phenylmethoxy-1-pyridin-2-ylmethanimine
CID 87293171
[(E)-[phenyl(pyridin-2-yl)methylidene]amino] butanoate
CID 10084390
N'-(dipyridin-2-ylmethylideneamino)-N,N-dimethylcarbamimidothioate;N'-(dipyridin-2-ylmethylideneamino)-N,N-dimethylcarbamimidothioate;nickel(2+)
CID 25193514
methyl N-cyanopyridine-2-carboximidate
CID 10012189
1-pyridin-2-ylethanethione
CID 89010255
(NE)-N-[pyridin-2-yl(pyridin-4-yl)methylidene]hydroxylamine
CID 137180821

Frequently Asked Questions

What is the IUPAC name of N-methoxy-1,1-dipyridin-2-ylmethanimine?
The IUPAC name of N-methoxy-1,1-dipyridin-2-ylmethanimine (CID 59833599) is N-methoxy-1,1-dipyridin-2-ylmethanimine.
What is the SMILES notation for N-methoxy-1,1-dipyridin-2-ylmethanimine?
The canonical SMILES for N-methoxy-1,1-dipyridin-2-ylmethanimine is CON=C(c1ccccn1)c1ccccn1.
What is the InChIKey of N-methoxy-1,1-dipyridin-2-ylmethanimine?
The InChIKey is CTJJKOSKZZJKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-16-15-12(10-6-2-4-8-13-10)11-7-3-5-9-14-11/h2-9H,1H3.
What are the key properties of N-methoxy-1,1-dipyridin-2-ylmethanimine?
N-methoxy-1,1-dipyridin-2-ylmethanimine has a molecular weight of 213.24 g/mol, XLogP of 1.88, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1,1-dipyridin-2-ylmethanimine is sourced from PubChem (CID 59833599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).