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

C10H13N — CID 130731712

IUPAC(2S)-2,6-dimethyl-2,3-dihydro-1H-indole
SMILESCc1ccc2c(c1)N[C@@H](C)C2
InChIInChI=1S/C10H13N/c1-7-3-4-9-6-8(2)11-10(9)5-7/h3-5,8,11H,6H2,1-2H3/t8-/m0/s1
InChIKeyJZPSVEFJNPUXMX-QMMMGPOBSA-N
MW147.22 g/mol
LogP2.35
Rot. Bonds

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

(2S)-2,6-dimethyl-2,3-dihydro-1H-indole (PubChem CID 130731712) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is (2S)-2,6-dimethyl-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name(2S)-2,6-dimethyl-2,3-dihydro-1H-indole
PubChem CID130731712
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name(2S)-2,6-dimethyl-2,3-dihydro-1H-indole
SMILESCc1ccc2c(c1)N[C@@H](C)C2
InChIInChI=1S/C10H13N/c1-7-3-4-9-6-8(2)11-10(9)5-7/h3-5,8,11H,6H2,1-2H3/t8-/m0/s1
InChIKeyJZPSVEFJNPUXMX-QMMMGPOBSA-N
XLogP2.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2S)-2,6-dimethyl-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

Related Compounds

6-methyl-2-propan-2-yl-2,3-dihydro-1H-indole
CID 89025776
(2R)-2-methyl-2,3-dihydro-1H-indole;hydrochloride
CID 155819591
2,6-dimethyl-1,2,3,4-tetrahydroquinoline
CID 13094330
N-methyl-1-(2-methyl-2,3-dihydro-1H-indol-6-yl)ethanamine
CID 117203582
3,6-dimethyl-3,4-dihydro-2H-1,4-benzothiazine
CID 84618482
2,4,4,6-tetramethyl-2,3-dihydro-1H-quinoline
CID 117272132
(2R)-5-(2,5-dimethylpyrrol-1-yl)-2-methyl-2,3-dihydro-1H-indole
CID 20813927
5-ethyl-2-methyl-2,3-dihydro-1H-indole
CID 70571795
formic acid;2-methyl-2,3-dihydro-1H-indole
CID 144722451
7-methyl-1,2,3,4-tetrahydroquinoline-3-carboxylic acid
CID 83753051
2-methyl-2,3-dihydro-1H-indole;2-methyl-1,3-dihydroisoindole
CID 158613443
2,6-dimethyl-1,5,6,7-tetrahydropyrrolo[2,3-f]indole
CID 89011412

Frequently Asked Questions

What is the IUPAC name of (2S)-2,6-dimethyl-2,3-dihydro-1H-indole?
The IUPAC name of (2S)-2,6-dimethyl-2,3-dihydro-1H-indole (CID 130731712) is (2S)-2,6-dimethyl-2,3-dihydro-1H-indole.
What is the SMILES notation for (2S)-2,6-dimethyl-2,3-dihydro-1H-indole?
The canonical SMILES for (2S)-2,6-dimethyl-2,3-dihydro-1H-indole is Cc1ccc2c(c1)N[C@@H](C)C2.
What is the InChIKey of (2S)-2,6-dimethyl-2,3-dihydro-1H-indole?
The InChIKey is JZPSVEFJNPUXMX-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H13N/c1-7-3-4-9-6-8(2)11-10(9)5-7/h3-5,8,11H,6H2,1-2H3/t8-/m0/s1.
What are the key properties of (2S)-2,6-dimethyl-2,3-dihydro-1H-indole?
(2S)-2,6-dimethyl-2,3-dihydro-1H-indole has a molecular weight of 147.22 g/mol, XLogP of 2.35, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,6-dimethyl-2,3-dihydro-1H-indole is sourced from PubChem (CID 130731712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).