N-methyl-1-pyridin-2-ylethanimine

C8H10N2 — CID 12970828

IUPACN-methyl-1-pyridin-2-ylethanimine
SMILESC/N=C(\C)c1ccccn1
InChIInChI=1S/C8H10N2/c1-7(9-2)8-5-3-4-6-10-8/h3-6H,1-2H3/b9-7+
InChIKeyIHOSZVRZVKLCSX-VQHVLOKHSA-N
MW134.18 g/mol
LogP1.52
Rot. Bonds1

About N-methyl-1-pyridin-2-ylethanimine

N-methyl-1-pyridin-2-ylethanimine (PubChem CID 12970828) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is N-methyl-1-pyridin-2-ylethanimine.

Molecular Properties

Compound NameN-methyl-1-pyridin-2-ylethanimine
PubChem CID12970828
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC NameN-methyl-1-pyridin-2-ylethanimine
SMILESC/N=C(\C)c1ccccn1
InChIInChI=1S/C8H10N2/c1-7(9-2)8-5-3-4-6-10-8/h3-6H,1-2H3/b9-7+
InChIKeyIHOSZVRZVKLCSX-VQHVLOKHSA-N
XLogP1.52
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 N-methyl-1-pyridin-2-ylethanimine?
The IUPAC name of N-methyl-1-pyridin-2-ylethanimine (CID 12970828) is N-methyl-1-pyridin-2-ylethanimine.
What is the SMILES notation for N-methyl-1-pyridin-2-ylethanimine?
The canonical SMILES for N-methyl-1-pyridin-2-ylethanimine is C/N=C(\C)c1ccccn1.
What is the InChIKey of N-methyl-1-pyridin-2-ylethanimine?
The InChIKey is IHOSZVRZVKLCSX-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H10N2/c1-7(9-2)8-5-3-4-6-10-8/h3-6H,1-2H3/b9-7+.
What are the key properties of N-methyl-1-pyridin-2-ylethanimine?
N-methyl-1-pyridin-2-ylethanimine has a molecular weight of 134.18 g/mol, XLogP of 1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyridin-2-ylethanimine is sourced from PubChem (CID 12970828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).