N-methyl-1-naphthalen-2-ylethanimine

C13H13N — CID 23573823

IUPACN-methyl-1-naphthalen-2-ylethanimine
SMILESC/N=C(\C)c1ccc2ccccc2c1
InChIInChI=1S/C13H13N/c1-10(14-2)12-8-7-11-5-3-4-6-13(11)9-12/h3-9H,1-2H3/b14-10+
InChIKeyPGBLOAPIEVTILD-GXDHUFHOSA-N
MW183.25 g/mol
LogP3.28
Rot. Bonds1

About N-methyl-1-naphthalen-2-ylethanimine

N-methyl-1-naphthalen-2-ylethanimine (PubChem CID 23573823) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is N-methyl-1-naphthalen-2-ylethanimine.

Molecular Properties

Compound NameN-methyl-1-naphthalen-2-ylethanimine
PubChem CID23573823
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC NameN-methyl-1-naphthalen-2-ylethanimine
SMILESC/N=C(\C)c1ccc2ccccc2c1
InChIInChI=1S/C13H13N/c1-10(14-2)12-8-7-11-5-3-4-6-13(11)9-12/h3-9H,1-2H3/b14-10+
InChIKeyPGBLOAPIEVTILD-GXDHUFHOSA-N
XLogP3.28
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methyl-1-naphthalen-2-ylethanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-naphthalen-2-ylethanimine?
The IUPAC name of N-methyl-1-naphthalen-2-ylethanimine (CID 23573823) is N-methyl-1-naphthalen-2-ylethanimine.
What is the SMILES notation for N-methyl-1-naphthalen-2-ylethanimine?
The canonical SMILES for N-methyl-1-naphthalen-2-ylethanimine is C/N=C(\C)c1ccc2ccccc2c1.
What is the InChIKey of N-methyl-1-naphthalen-2-ylethanimine?
The InChIKey is PGBLOAPIEVTILD-GXDHUFHOSA-N. The full InChI is InChI=1S/C13H13N/c1-10(14-2)12-8-7-11-5-3-4-6-13(11)9-12/h3-9H,1-2H3/b14-10+.
What are the key properties of N-methyl-1-naphthalen-2-ylethanimine?
N-methyl-1-naphthalen-2-ylethanimine has a molecular weight of 183.25 g/mol, XLogP of 3.28, 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-ylethanimine is sourced from PubChem (CID 23573823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).