N-methyl-1-naphthalen-2-ylmethanimine

C12H11N — CID 21056336

IUPACN-methyl-1-naphthalen-2-ylmethanimine
SMILESC/N=C/c1ccc2ccccc2c1
InChIInChI=1S/C12H11N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9+
InChIKeyAGGXQDCVTKTEKZ-UKTHLTGXSA-N
MW169.23 g/mol
LogP2.89
Rot. Bonds1

About N-methyl-1-naphthalen-2-ylmethanimine

N-methyl-1-naphthalen-2-ylmethanimine (PubChem CID 21056336) has the molecular formula C12H11N and a molecular weight of 169.23 g/mol. Its IUPAC name is N-methyl-1-naphthalen-2-ylmethanimine.

Molecular Properties

Compound NameN-methyl-1-naphthalen-2-ylmethanimine
PubChem CID21056336
Molecular FormulaC12H11N
Molecular Weight169.23 g/mol
Exact Mass169.09
IUPAC NameN-methyl-1-naphthalen-2-ylmethanimine
SMILESC/N=C/c1ccc2ccccc2c1
InChIInChI=1S/C12H11N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9+
InChIKeyAGGXQDCVTKTEKZ-UKTHLTGXSA-N
XLogP2.89
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-naphthalen-2-ylmethanimine?
The IUPAC name of N-methyl-1-naphthalen-2-ylmethanimine (CID 21056336) is N-methyl-1-naphthalen-2-ylmethanimine.
What is the SMILES notation for N-methyl-1-naphthalen-2-ylmethanimine?
The canonical SMILES for N-methyl-1-naphthalen-2-ylmethanimine is C/N=C/c1ccc2ccccc2c1.
What is the InChIKey of N-methyl-1-naphthalen-2-ylmethanimine?
The InChIKey is AGGXQDCVTKTEKZ-UKTHLTGXSA-N. The full InChI is InChI=1S/C12H11N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9+.
What are the key properties of N-methyl-1-naphthalen-2-ylmethanimine?
N-methyl-1-naphthalen-2-ylmethanimine has a molecular weight of 169.23 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-naphthalen-2-ylmethanimine is sourced from PubChem (CID 21056336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).