[3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine

C14H20N2O — CID 117171670

IUPAC[3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine
SMILESCCOCc1cn(CC)c2cccc(CN)c12
InChIInChI=1S/C14H20N2O/c1-3-16-9-12(10-17-4-2)14-11(8-15)6-5-7-13(14)16/h5-7,9H,3-4,8,10,15H2,1-2H3
InChIKeyGGOFHUZXJCGDNH-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.66
Rot. Bonds5

About [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine

[3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine (PubChem CID 117171670) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine.

Molecular Properties

Compound Name[3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine
PubChem CID117171670
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name[3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine
SMILESCCOCc1cn(CC)c2cccc(CN)c12
InChIInChI=1S/C14H20N2O/c1-3-16-9-12(10-17-4-2)14-11(8-15)6-5-7-13(14)16/h5-7,9H,3-4,8,10,15H2,1-2H3
InChIKeyGGOFHUZXJCGDNH-UHFFFAOYSA-N
XLogP2.66
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(ethoxymethyl)-1-ethylindol-4-amine
CID 117171998
[1-ethyl-3-[(4-fluorophenoxy)methyl]indol-4-yl]methanamine
CID 117171659
[3-(ethoxymethyl)-1-methylindol-7-yl]methanamine
CID 117181731
O-[(1-ethyl-3-methylindol-4-yl)methyl]hydroxylamine
CID 117204415
1-ethyl-3-(phenoxymethyl)indol-4-amine
CID 117171827
(3-ethyl-1-methylindol-4-yl)methanamine
CID 115017614
1-ethyl-3-[(3-hydroxyphenoxy)methyl]indol-4-ol
CID 117171916
3-(4-chloro-1-ethylindol-3-yl)propan-1-amine
CID 117119707
3-[(dimethylamino)methyl]-1-ethylindol-4-amine
CID 117171719
1-ethyl-3-[(2-fluorophenoxy)methyl]-4-methylindole
CID 117184639
3-[(1-ethyl-4-methylindol-3-yl)methoxy]phenol
CID 117184653
[3-[(dimethylamino)methyl]-1-propan-2-ylindol-4-yl]methanamine
CID 117171620

Frequently Asked Questions

What is the IUPAC name of [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine?
The IUPAC name of [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine (CID 117171670) is [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine.
What is the SMILES notation for [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine?
The canonical SMILES for [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine is CCOCc1cn(CC)c2cccc(CN)c12.
What is the InChIKey of [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine?
The InChIKey is GGOFHUZXJCGDNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-16-9-12(10-17-4-2)14-11(8-15)6-5-7-13(14)16/h5-7,9H,3-4,8,10,15H2,1-2H3.
What are the key properties of [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine?
[3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine has a molecular weight of 232.33 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(ethoxymethyl)-1-ethylindol-4-yl]methanamine is sourced from PubChem (CID 117171670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).