4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole

C17H19N — CID 5150094

IUPAC4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole
SMILESCc1ccc(C2Cc3c(C)cc(C)cc3N2)cc1
InChIInChI=1S/C17H19N/c1-11-4-6-14(7-5-11)16-10-15-13(3)8-12(2)9-17(15)18-16/h4-9,16,18H,10H2,1-3H3
InChIKeyVCFVNYQHTHGKQW-UHFFFAOYSA-N
MW237.35 g/mol
LogP4.32
Rot. Bonds1

About 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole

4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole (PubChem CID 5150094) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole
PubChem CID5150094
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole
SMILESCc1ccc(C2Cc3c(C)cc(C)cc3N2)cc1
InChIInChI=1S/C17H19N/c1-11-4-6-14(7-5-11)16-10-15-13(3)8-12(2)9-17(15)18-16/h4-9,16,18H,10H2,1-3H3
InChIKeyVCFVNYQHTHGKQW-UHFFFAOYSA-N
XLogP4.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole 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 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole?
The IUPAC name of 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole (CID 5150094) is 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole.
What is the SMILES notation for 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole?
The canonical SMILES for 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole is Cc1ccc(C2Cc3c(C)cc(C)cc3N2)cc1.
What is the InChIKey of 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole?
The InChIKey is VCFVNYQHTHGKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-11-4-6-14(7-5-11)16-10-15-13(3)8-12(2)9-17(15)18-16/h4-9,16,18H,10H2,1-3H3.
What are the key properties of 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole?
4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole has a molecular weight of 237.35 g/mol, XLogP of 4.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole is sourced from PubChem (CID 5150094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).