N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine

C13H18N2O — CID 144980968

IUPACN,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine
SMILESCc1c[nH]c2cc(OCCN(C)C)ccc12
InChIInChI=1S/C13H18N2O/c1-10-9-14-13-8-11(4-5-12(10)13)16-7-6-15(2)3/h4-5,8-9,14H,6-7H2,1-3H3
InChIKeyGFVQEWZBODKDBF-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.42
Rot. Bonds4

About N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine

N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine (PubChem CID 144980968) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine
PubChem CID144980968
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC NameN,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine
SMILESCc1c[nH]c2cc(OCCN(C)C)ccc12
InChIInChI=1S/C13H18N2O/c1-10-9-14-13-8-11(4-5-12(10)13)16-7-6-15(2)3/h4-5,8-9,14H,6-7H2,1-3H3
InChIKeyGFVQEWZBODKDBF-UHFFFAOYSA-N
XLogP2.42
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,8-bis[2-(dimethylamino)ethoxy]-5H-phenanthridin-6-one
CID 57439762
2-(3,4-dimethylphenoxy)-N,N-dimethylethanamine
CID 82075858
2,7-bis[2-(dimethylamino)ethoxy]-10H-acridin-9-one
CID 57439652
5-[2-(dimethylamino)ethoxy]-1,3-dihydrobenzimidazole-2-thione
CID 121006527
6-[[3-[2-(dimethylamino)ethyl]-1H-indol-6-yl]oxy]hexanoic acid
CID 175491937
2-(4-ethyl-3-methylphenoxy)-N,N-dimethylethanamine
CID 163472505
5-ethoxy-3-methyl-1H-indole
CID 82490542
ethane;2-(3-methoxy-4-methylphenoxy)-N,N-dimethylethanamine
CID 144693051
2-(3,4-dichlorophenoxy)-N,N-dimethylethanamine
CID 86117410
7-[2-(dimethylamino)ethoxy]-2-methylchromen-4-one
CID 110174145
6-[2-(dimethylamino)ethoxy]-9H-pyrido[3,4-b]indole-3-carboxylic acid
CID 82220385
2,6-bis[2-(dimethylamino)ethoxy]xanthen-9-one
CID 57439560

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine?
The IUPAC name of N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine (CID 144980968) is N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine.
What is the SMILES notation for N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine?
The canonical SMILES for N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine is Cc1c[nH]c2cc(OCCN(C)C)ccc12.
What is the InChIKey of N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine?
The InChIKey is GFVQEWZBODKDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-10-9-14-13-8-11(4-5-12(10)13)16-7-6-15(2)3/h4-5,8-9,14H,6-7H2,1-3H3.
What are the key properties of N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine?
N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine has a molecular weight of 218.30 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(3-methyl-1H-indol-6-yl)oxy]ethanamine is sourced from PubChem (CID 144980968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).