2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole

C17H19N — CID 22199925

IUPAC2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole
SMILESCc1cccc(CN2c3ccccc3CC2C)c1
InChIInChI=1S/C17H19N/c1-13-6-5-7-15(10-13)12-18-14(2)11-16-8-3-4-9-17(16)18/h3-10,14H,11-12H2,1-2H3
InChIKeyJZZJTXXHYDZQOW-UHFFFAOYSA-N
MW237.35 g/mol
LogP3.95
Rot. Bonds2

About 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole

2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole (PubChem CID 22199925) has the molecular formula C17H19N and a molecular weight of 237.35 g/mol. Its IUPAC name is 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole.

Molecular Properties

Compound Name2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole
PubChem CID22199925
Molecular FormulaC17H19N
Molecular Weight237.35 g/mol
Exact Mass237.15
IUPAC Name2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole
SMILESCc1cccc(CN2c3ccccc3CC2C)c1
InChIInChI=1S/C17H19N/c1-13-6-5-7-15(10-13)12-18-14(2)11-16-8-3-4-9-17(16)18/h3-10,14H,11-12H2,1-2H3
InChIKeyJZZJTXXHYDZQOW-UHFFFAOYSA-N
XLogP3.95
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 40809955
1-[(4-fluorophenyl)methyl]-2-methyl-2,3-dihydroindole
CID 22199928
2-methyl-1-[(4-methylsulfanylphenyl)methyl]-2,3-dihydroindole
CID 173088754
N-methyl-1-[4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
CID 62423502
2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-N-(3-methylphenyl)acetamide
CID 2652852
2-methoxy-4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]benzonitrile
CID 106787973
[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]phenyl]methanamine
CID 18071187
N-ethyl-2-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)acetamide
CID 109011137
[6-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-2-pyridinyl]methanamine
CID 106905554
N-ethyl-3-(2-methyl-2,3-dihydroindol-1-yl)-N-(3-methylphenyl)propanamide
CID 109042621
[5-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-2-pyridinyl]hydrazine
CID 62244249
1-[[4-(difluoromethylsulfonyl)phenyl]methyl]-2-methyl-2,3-dihydroindole
CID 112803274

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole?
The IUPAC name of 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole (CID 22199925) is 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole.
What is the SMILES notation for 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole?
The canonical SMILES for 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole is Cc1cccc(CN2c3ccccc3CC2C)c1.
What is the InChIKey of 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole?
The InChIKey is JZZJTXXHYDZQOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N/c1-13-6-5-7-15(10-13)12-18-14(2)11-16-8-3-4-9-17(16)18/h3-10,14H,11-12H2,1-2H3.
What are the key properties of 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole?
2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole has a molecular weight of 237.35 g/mol, XLogP of 3.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(3-methylphenyl)methyl]-2,3-dihydroindole is sourced from PubChem (CID 22199925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).