2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine

C14H21NO2 — CID 54428701

IUPAC2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine
SMILESCCOc1cc(CCN)c2c(c1OC)CCC2
InChIInChI=1S/C14H21NO2/c1-3-17-13-9-10(7-8-15)11-5-4-6-12(11)14(13)16-2/h9H,3-8,15H2,1-2H3
InChIKeyWFYSSTHMJYADMI-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.08
Rot. Bonds5

About 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine

2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine (PubChem CID 54428701) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine.

Molecular Properties

Compound Name2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine
PubChem CID54428701
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine
SMILESCCOc1cc(CCN)c2c(c1OC)CCC2
InChIInChI=1S/C14H21NO2/c1-3-17-13-9-10(7-8-15)11-5-4-6-12(11)14(13)16-2/h9H,3-8,15H2,1-2H3
InChIKeyWFYSSTHMJYADMI-UHFFFAOYSA-N
XLogP2.08
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6,7-dimethoxy-2,3-dihydro-1H-inden-4-yl)ethanamine
CID 54401717
2-(6-ethoxy-2,3-dihydro-1H-inden-5-yl)ethanamine
CID 170888274
2-(2-bromo-4-ethoxy-5-methoxyphenyl)ethanamine
CID 170868746
2-(4-methoxy-2,3-dihydro-1H-inden-5-yl)ethanamine
CID 117282550
2-(2-ethoxy-4,5-difluorophenyl)ethanamine
CID 83880849
2-(2,5-dimethoxy-3,4-dimethylphenyl)ethanamine
CID 22238091
(4,7-dimethoxy-2,3-dihydro-1H-inden-5-yl)methanol
CID 84676076
2-(4-tert-butyl-5-ethoxy-2-methylphenyl)ethanamine
CID 170888098
2-(5-ethoxy-4-methoxy-2-nitrophenyl)ethanamine
CID 112720413
3-(4-ethoxy-2,5-dimethoxyphenyl)propan-1-amine
CID 171474993
5-(3-aminopropyl)-3-ethoxy-2-methoxyphenol
CID 117323946
5-chloro-7,8-diethoxy-3,4-dihydro-2H-naphthalen-1-one
CID 55109229

Frequently Asked Questions

What is the IUPAC name of 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine?
The IUPAC name of 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine (CID 54428701) is 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine.
What is the SMILES notation for 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine?
The canonical SMILES for 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine is CCOc1cc(CCN)c2c(c1OC)CCC2.
What is the InChIKey of 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine?
The InChIKey is WFYSSTHMJYADMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-3-17-13-9-10(7-8-15)11-5-4-6-12(11)14(13)16-2/h9H,3-8,15H2,1-2H3.
What are the key properties of 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine?
2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine has a molecular weight of 235.33 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethoxy-7-methoxy-2,3-dihydro-1H-inden-4-yl)ethanamine is sourced from PubChem (CID 54428701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).