7-methyl-1-(2-methylpropyl)-2,3-dihydroindole

C13H19N — CID 174365784

IUPAC7-methyl-1-(2-methylpropyl)-2,3-dihydroindole
SMILESCc1cccc2c1N(CC(C)C)CC2
InChIInChI=1S/C13H19N/c1-10(2)9-14-8-7-12-6-4-5-11(3)13(12)14/h4-6,10H,7-9H2,1-3H3
InChIKeyIPQCJNQBZXYHHM-UHFFFAOYSA-N
MW189.30 g/mol
LogP3.01
Rot. Bonds2

About 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole

7-methyl-1-(2-methylpropyl)-2,3-dihydroindole (PubChem CID 174365784) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole.

Molecular Properties

Compound Name7-methyl-1-(2-methylpropyl)-2,3-dihydroindole
PubChem CID174365784
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name7-methyl-1-(2-methylpropyl)-2,3-dihydroindole
SMILESCc1cccc2c1N(CC(C)C)CC2
InChIInChI=1S/C13H19N/c1-10(2)9-14-8-7-12-6-4-5-11(3)13(12)14/h4-6,10H,7-9H2,1-3H3
InChIKeyIPQCJNQBZXYHHM-UHFFFAOYSA-N
XLogP3.01
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole 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 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole?
The IUPAC name of 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole (CID 174365784) is 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole.
What is the SMILES notation for 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole?
The canonical SMILES for 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole is Cc1cccc2c1N(CC(C)C)CC2.
What is the InChIKey of 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole?
The InChIKey is IPQCJNQBZXYHHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N/c1-10(2)9-14-8-7-12-6-4-5-11(3)13(12)14/h4-6,10H,7-9H2,1-3H3.
What are the key properties of 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole?
7-methyl-1-(2-methylpropyl)-2,3-dihydroindole has a molecular weight of 189.30 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1-(2-methylpropyl)-2,3-dihydroindole is sourced from PubChem (CID 174365784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).