6-(dimethylamino)naphthalene-2-carbaldehyde

C13H13NO — CID 25195386

IUPAC6-(dimethylamino)naphthalene-2-carbaldehyde
SMILESCN(C)c1ccc2cc(C=O)ccc2c1
InChIInChI=1S/C13H13NO/c1-14(2)13-6-5-11-7-10(9-15)3-4-12(11)8-13/h3-9H,1-2H3
InChIKeyIVFSOOIWIYPDLX-UHFFFAOYSA-N
MW199.25 g/mol
LogP2.72
Rot. Bonds2

About 6-(dimethylamino)naphthalene-2-carbaldehyde

6-(dimethylamino)naphthalene-2-carbaldehyde (PubChem CID 25195386) has the molecular formula C13H13NO and a molecular weight of 199.25 g/mol. Its IUPAC name is 6-(dimethylamino)naphthalene-2-carbaldehyde.

Molecular Properties

Compound Name6-(dimethylamino)naphthalene-2-carbaldehyde
PubChem CID25195386
Molecular FormulaC13H13NO
Molecular Weight199.25 g/mol
Exact Mass199.10
IUPAC Name6-(dimethylamino)naphthalene-2-carbaldehyde
SMILESCN(C)c1ccc2cc(C=O)ccc2c1
InChIInChI=1S/C13H13NO/c1-14(2)13-6-5-11-7-10(9-15)3-4-12(11)8-13/h3-9H,1-2H3
InChIKeyIVFSOOIWIYPDLX-UHFFFAOYSA-N
XLogP2.72
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 6-(dimethylamino)naphthalene-2-carbaldehyde 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 6-(dimethylamino)naphthalene-2-carbaldehyde?
The IUPAC name of 6-(dimethylamino)naphthalene-2-carbaldehyde (CID 25195386) is 6-(dimethylamino)naphthalene-2-carbaldehyde.
What is the SMILES notation for 6-(dimethylamino)naphthalene-2-carbaldehyde?
The canonical SMILES for 6-(dimethylamino)naphthalene-2-carbaldehyde is CN(C)c1ccc2cc(C=O)ccc2c1.
What is the InChIKey of 6-(dimethylamino)naphthalene-2-carbaldehyde?
The InChIKey is IVFSOOIWIYPDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO/c1-14(2)13-6-5-11-7-10(9-15)3-4-12(11)8-13/h3-9H,1-2H3.
What are the key properties of 6-(dimethylamino)naphthalene-2-carbaldehyde?
6-(dimethylamino)naphthalene-2-carbaldehyde has a molecular weight of 199.25 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)naphthalene-2-carbaldehyde is sourced from PubChem (CID 25195386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).