2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine

C15H22N2O — CID 113447953

IUPAC2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
SMILESCNC(CN1CCc2ccccc21)C1CCOC1
InChIInChI=1S/C15H22N2O/c1-16-14(13-7-9-18-11-13)10-17-8-6-12-4-2-3-5-15(12)17/h2-5,13-14,16H,6-11H2,1H3
InChIKeyOAOKSUKDNBJNBO-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.67
Rot. Bonds4

About 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine

2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine (PubChem CID 113447953) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
PubChem CID113447953
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
SMILESCNC(CN1CCc2ccccc21)C1CCOC1
InChIInChI=1S/C15H22N2O/c1-16-14(13-7-9-18-11-13)10-17-8-6-12-4-2-3-5-15(12)17/h2-5,13-14,16H,6-11H2,1H3
InChIKeyOAOKSUKDNBJNBO-UHFFFAOYSA-N
XLogP1.67
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methyl-2,3-dihydro-1H-indol-1-yl)ethan-1-amine
CID 20116695
[2-(2,3-dihydro-1H-indol-1-yl)ethyl](methyl)amine
CID 28279618
4-ethyl-N-(oxolan-3-ylmethyl)aniline
CID 43195564
3-N,3-N,2-trimethyl-1-N-[1-(oxolan-3-yl)ethyl]benzene-1,3-diamine
CID 121524806
N-[[4-fluoro-1-(3-methoxypropyl)-2,3-dihydroindol-3-yl]methyl]cyclopropanamine
CID 70253156
[4-Fluoro-1-(3-methoxypropyl)-2,3-dihydroindol-2-yl]methanamine
CID 70323487
N-[[6-fluoro-1-(3-methoxypropyl)-2,3-dihydroindol-3-yl]methyl]cyclopropanamine
CID 70951573
(3R,4R)-4-(5-fluoro-3,3-dimethyl-2H-indol-1-yl)oxolan-3-amine
CID 141112500
2-ethyl-N-(oxolan-3-ylmethyl)aniline
CID 43195651
3-ethyl-N-(oxolan-3-ylmethyl)aniline
CID 43196070
2-methyl-N-(oxolan-3-ylmethyl)aniline
CID 43196705
2-tert-butyl-N-(oxolan-3-ylmethyl)aniline
CID 43682966

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine?
The IUPAC name of 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine (CID 113447953) is 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine.
What is the SMILES notation for 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine?
The canonical SMILES for 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine is CNC(CN1CCc2ccccc21)C1CCOC1.
What is the InChIKey of 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine?
The InChIKey is OAOKSUKDNBJNBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-16-14(13-7-9-18-11-13)10-17-8-6-12-4-2-3-5-15(12)17/h2-5,13-14,16H,6-11H2,1H3.
What are the key properties of 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine?
2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine has a molecular weight of 246.35 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroindol-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 113447953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).