N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine

C17H24N2O — CID 65165238

IUPACN-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine
SMILESCNCCc1cn(CCC2CCCO2)c2ccccc12
InChIInChI=1S/C17H24N2O/c1-18-10-8-14-13-19(11-9-15-5-4-12-20-15)17-7-3-2-6-16(14)17/h2-3,6-7,13,15,18H,4-5,8-12H2,1H3
InChIKeyPDGVJBAMVSZVJI-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.97
Rot. Bonds6

About N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine

N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine (PubChem CID 65165238) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine
PubChem CID65165238
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine
SMILESCNCCc1cn(CCC2CCCO2)c2ccccc12
InChIInChI=1S/C17H24N2O/c1-18-10-8-14-13-19(11-9-15-5-4-12-20-15)17-7-3-2-6-16(14)17/h2-3,6-7,13,15,18H,4-5,8-12H2,1H3
InChIKeyPDGVJBAMVSZVJI-UHFFFAOYSA-N
XLogP2.97
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[1-[3-(oxolan-2-yl)propyl]indol-3-yl]methanamine
CID 65165521
N-[[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]methyl]propan-1-amine
CID 65165632
N-[[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]methyl]ethanamine
CID 65165577
N-methyl-1-[1-[2-(oxolan-2-yl)ethyl]indol-4-yl]methanamine
CID 65162434
1-(oxolan-2-yl)-N-[(1-propylindol-3-yl)methyl]methanamine
CID 119027030
N-[(1-ethylindol-3-yl)methyl]-1-[(2S)-oxolan-2-yl]methanamine
CID 29228595
2-[1-[(5,5-dimethyloxolan-2-yl)methyl]indol-3-yl]-N-methylethanamine
CID 116524206
2-[2-(methylamino)ethyl]-N-[2-(oxolan-2-yl)ethyl]benzamide
CID 104547635
N-[(1-benzylindol-3-yl)methyl]-1-[(2S)-oxolan-2-yl]methanamine
CID 27210541
N-methyl-1-[1-[3-(oxolan-2-yl)propyl]indazol-3-yl]methanamine
CID 65165688
N-[2-(2-methylphenyl)ethyl]-2-(oxolan-2-yl)ethanamine
CID 79763588
oxolan-2-ylmethyl 2-[2-(methylamino)ethyl]benzoate
CID 104548522

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine?
The IUPAC name of N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine (CID 65165238) is N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine?
The canonical SMILES for N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine is CNCCc1cn(CCC2CCCO2)c2ccccc12.
What is the InChIKey of N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine?
The InChIKey is PDGVJBAMVSZVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-18-10-8-14-13-19(11-9-15-5-4-12-20-15)17-7-3-2-6-16(14)17/h2-3,6-7,13,15,18H,4-5,8-12H2,1H3.
What are the key properties of N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine?
N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine has a molecular weight of 272.39 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-[2-(oxolan-2-yl)ethyl]indol-3-yl]ethanamine is sourced from PubChem (CID 65165238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).