1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole

C20H21N — CID 118443380

IUPAC1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole
SMILESCC1=Cc2c(cccc2N2c3ccccc3CC2C)C1C
InChIInChI=1S/C20H21N/c1-13-11-18-17(15(13)3)8-6-10-20(18)21-14(2)12-16-7-4-5-9-19(16)21/h4-11,14-15H,12H2,1-3H3
InChIKeyHPRNXPKXIGGLMR-UHFFFAOYSA-N
MW275.39 g/mol
LogP5.29
Rot. Bonds1

About 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole

1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole (PubChem CID 118443380) has the molecular formula C20H21N and a molecular weight of 275.39 g/mol. Its IUPAC name is 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole
PubChem CID118443380
Molecular FormulaC20H21N
Molecular Weight275.39 g/mol
Exact Mass275.17
IUPAC Name1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole
SMILESCC1=Cc2c(cccc2N2c3ccccc3CC2C)C1C
InChIInChI=1S/C20H21N/c1-13-11-18-17(15(13)3)8-6-10-20(18)21-14(2)12-16-7-4-5-9-19(16)21/h4-11,14-15H,12H2,1-3H3
InChIKeyHPRNXPKXIGGLMR-UHFFFAOYSA-N
XLogP5.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500275.39
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole with MolForge

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Related Compounds

[2-methyl-4-(2-methyl-2,3-dihydroindol-1-yl)-1H-inden-1-yl]-[2-methyl-4-(2-methyl-3,4-dihydro-2H-quinolin-1-yl)-1H-inden-1-yl]-diphenyl-λ4-sulfane
CID 118370113
1-[1-[[4-(3,4-dihydro-2H-quinolin-1-yl)-2-methyl-1H-inden-1-yl]methyl]-2-methyl-1H-inden-4-yl]-2-methyl-3,4-dihydro-2H-quinoline
CID 122433936
1-(3-chloro-2-nitrophenyl)-2-methyl-2,3-dihydroindole
CID 104838682
1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]ethanol
CID 43510148
(1S)-1-[2-(2-methyl-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
CID 103959670
2-methyl-1-(4-phenylphenyl)-2,3-dihydroindole
CID 20685477
3-methyl-4-(2-methyl-2,3-dihydroindol-1-yl)benzonitrile
CID 63511241
2-fluoro-6-(2-methyl-2,3-dihydroindol-1-yl)benzonitrile
CID 55387468
[2,3-difluoro-4-(2-methyl-2,3-dihydroindol-1-yl)phenyl]methanamine
CID 107932681
(1S)-1-[2-fluoro-6-(2-methyl-2,3-dihydroindol-1-yl)phenyl]ethanol
CID 78939271
4-methyl-2-(2-methyl-2,3-dihydroindol-1-yl)benzonitrile
CID 55194408
(2R)-1-iodo-2-methyl-2,3-dihydroindole
CID 142057461

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole?
The IUPAC name of 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole (CID 118443380) is 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole.
What is the SMILES notation for 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole?
The canonical SMILES for 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole is CC1=Cc2c(cccc2N2c3ccccc3CC2C)C1C.
What is the InChIKey of 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole?
The InChIKey is HPRNXPKXIGGLMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N/c1-13-11-18-17(15(13)3)8-6-10-20(18)21-14(2)12-16-7-4-5-9-19(16)21/h4-11,14-15H,12H2,1-3H3.
What are the key properties of 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole?
1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole has a molecular weight of 275.39 g/mol, XLogP of 5.29, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-dimethyl-1H-inden-4-yl)-2-methyl-2,3-dihydroindole is sourced from PubChem (CID 118443380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).