1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine

C19H18N2 — CID 82536270

IUPAC1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine
SMILESCN1CCc2cc(Nc3ccc4ccccc4c3)ccc21
InChIInChI=1S/C19H18N2/c1-21-11-10-16-13-18(8-9-19(16)21)20-17-7-6-14-4-2-3-5-15(14)12-17/h2-9,12-13,20H,10-11H2,1H3
InChIKeyIMRWRFVTKKIWKL-UHFFFAOYSA-N
MW274.37 g/mol
LogP4.58
Rot. Bonds2

About 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine

1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine (PubChem CID 82536270) has the molecular formula C19H18N2 and a molecular weight of 274.37 g/mol. Its IUPAC name is 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine.

Molecular Properties

Compound Name1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine
PubChem CID82536270
Molecular FormulaC19H18N2
Molecular Weight274.37 g/mol
Exact Mass274.15
IUPAC Name1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine
SMILESCN1CCc2cc(Nc3ccc4ccccc4c3)ccc21
InChIInChI=1S/C19H18N2/c1-21-11-10-16-13-18(8-9-19(16)21)20-17-7-6-14-4-2-3-5-15(14)12-17/h2-9,12-13,20H,10-11H2,1H3
InChIKeyIMRWRFVTKKIWKL-UHFFFAOYSA-N
XLogP4.58
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine 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 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine?
The IUPAC name of 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine (CID 82536270) is 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine.
What is the SMILES notation for 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine?
The canonical SMILES for 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine is CN1CCc2cc(Nc3ccc4ccccc4c3)ccc21.
What is the InChIKey of 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine?
The InChIKey is IMRWRFVTKKIWKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2/c1-21-11-10-16-13-18(8-9-19(16)21)20-17-7-6-14-4-2-3-5-15(14)12-17/h2-9,12-13,20H,10-11H2,1H3.
What are the key properties of 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine?
1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine has a molecular weight of 274.37 g/mol, XLogP of 4.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-naphthalen-2-yl-2,3-dihydroindol-5-amine is sourced from PubChem (CID 82536270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).