7-methyl-3-(2-phenylethyl)-1H-indole

C17H17N — CID 174735389

IUPAC7-methyl-3-(2-phenylethyl)-1H-indole
SMILESCc1cccc2c(CCc3ccccc3)c[nH]c12
InChIInChI=1S/C17H17N/c1-13-6-5-9-16-15(12-18-17(13)16)11-10-14-7-3-2-4-8-14/h2-9,12,18H,10-11H2,1H3
InChIKeyGRPKHRKKLLYALP-UHFFFAOYSA-N
MW235.33 g/mol
LogP4.26
Rot. Bonds3

About 7-methyl-3-(2-phenylethyl)-1H-indole

7-methyl-3-(2-phenylethyl)-1H-indole (PubChem CID 174735389) has the molecular formula C17H17N and a molecular weight of 235.33 g/mol. Its IUPAC name is 7-methyl-3-(2-phenylethyl)-1H-indole.

Molecular Properties

Compound Name7-methyl-3-(2-phenylethyl)-1H-indole
PubChem CID174735389
Molecular FormulaC17H17N
Molecular Weight235.33 g/mol
Exact Mass235.14
IUPAC Name7-methyl-3-(2-phenylethyl)-1H-indole
SMILESCc1cccc2c(CCc3ccccc3)c[nH]c12
InChIInChI=1S/C17H17N/c1-13-6-5-9-16-15(12-18-17(13)16)11-10-14-7-3-2-4-8-14/h2-9,12,18H,10-11H2,1H3
InChIKeyGRPKHRKKLLYALP-UHFFFAOYSA-N
XLogP4.26
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-(7-methyl-1H-indol-3-yl)ethanamine chloride
CID 53351005
2-(7-methyl-1H-indol-3-yl)ethanamine;oxalic acid
CID 24802312
2-methyl-N-[2-(7-methyl-1H-indol-3-yl)ethyl]aniline
CID 143759207
4-(7-methyl-1H-indol-3-yl)butan-2-one
CID 28806455
2-(7-methyl-1H-indol-3-yl)ethyl-propan-2-ylazanium
CID 170598949
(2S)-2-amino-N-[2-(7-methyl-1H-indol-3-yl)ethyl]-3-phenylpropanamide;hydrochloride
CID 119322305
2-(7-methyl-1H-indol-3-yl)ethyl-propan-2-ylazanium iodide
CID 170339447
3-(ethoxymethyl)-7-methyl-1H-indole
CID 117186252
5-[2-(7-methyl-1H-indol-3-yl)ethylcarbamoyl]furan-2-carboxylic acid
CID 167925600
N-[(7-methyl-1H-indol-3-yl)methyl]benzenesulfonamide
CID 169029481
tert-butyl-dimethyl-[2-(7-methyl-1H-indol-3-yl)ethoxy]silane
CID 141078795
N-[4-(2-hydroxyethyl)phenyl]-3-(7-methyl-1H-indol-3-yl)propanamide
CID 111487131

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-(2-phenylethyl)-1H-indole?
The IUPAC name of 7-methyl-3-(2-phenylethyl)-1H-indole (CID 174735389) is 7-methyl-3-(2-phenylethyl)-1H-indole.
What is the SMILES notation for 7-methyl-3-(2-phenylethyl)-1H-indole?
The canonical SMILES for 7-methyl-3-(2-phenylethyl)-1H-indole is Cc1cccc2c(CCc3ccccc3)c[nH]c12.
What is the InChIKey of 7-methyl-3-(2-phenylethyl)-1H-indole?
The InChIKey is GRPKHRKKLLYALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N/c1-13-6-5-9-16-15(12-18-17(13)16)11-10-14-7-3-2-4-8-14/h2-9,12,18H,10-11H2,1H3.
What are the key properties of 7-methyl-3-(2-phenylethyl)-1H-indole?
7-methyl-3-(2-phenylethyl)-1H-indole has a molecular weight of 235.33 g/mol, XLogP of 4.26, 3 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-(2-phenylethyl)-1H-indole is sourced from PubChem (CID 174735389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).