2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine

C11H16N2O — CID 82276698

IUPAC2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine
SMILESCOc1cccc2c1NCC2CCN
InChIInChI=1S/C11H16N2O/c1-14-10-4-2-3-9-8(5-6-12)7-13-11(9)10/h2-4,8,13H,5-7,12H2,1H3
InChIKeyPYBYCTVTNVUJFP-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.55
Rot. Bonds3

About 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine

2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine (PubChem CID 82276698) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine
PubChem CID82276698
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine
SMILESCOc1cccc2c1NCC2CCN
InChIInChI=1S/C11H16N2O/c1-14-10-4-2-3-9-8(5-6-12)7-13-11(9)10/h2-4,8,13H,5-7,12H2,1H3
InChIKeyPYBYCTVTNVUJFP-UHFFFAOYSA-N
XLogP1.55
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(difluoromethyl)-7-methoxy-2,3-dihydro-1H-indole
CID 84668692
8-methoxy-N,N,3-trimethyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 82275705
7-chloro-3-propyl-2,3-dihydro-1H-indole
CID 106985714
N,N-dimethyl-2-(7-methyl-2,3-dihydro-1H-indol-3-yl)ethanamine
CID 169244277
3-(aminomethyl)-7-methoxy-1,3-dihydroindol-2-one
CID 82075718
methyl 2-(7-bromo-2,3-dihydro-1H-indol-3-yl)acetate
CID 115050329
8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline
CID 54763699
7-methyl-3-nonyl-2,3-dihydro-1H-indole
CID 106986257
7-methoxy-3-(3,3,5-trimethylcyclohexyl)-2,3-dihydro-1H-indole
CID 106986429
(3R,4R)-3-(aminomethyl)-8-ethoxy-1,2,3,4-tetrahydroquinolin-4-ol
CID 99981441
7-bromo-3-(2-methylpropyl)-2,3-dihydro-1H-indole
CID 106986374
(7-methyl-2,3-dihydro-1H-indol-3-yl)methanol
CID 82277392

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine?
The IUPAC name of 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine (CID 82276698) is 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine.
What is the SMILES notation for 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine?
The canonical SMILES for 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine is COc1cccc2c1NCC2CCN.
What is the InChIKey of 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine?
The InChIKey is PYBYCTVTNVUJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-14-10-4-2-3-9-8(5-6-12)7-13-11(9)10/h2-4,8,13H,5-7,12H2,1H3.
What are the key properties of 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine?
2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine has a molecular weight of 192.26 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxy-2,3-dihydro-1H-indol-3-yl)ethanamine is sourced from PubChem (CID 82276698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).