N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine

C15H20N2O2 — CID 82500566

IUPACN-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine
SMILESCC(C)NCCc1c[nH]c2cc3c(cc12)OCCO3
InChIInChI=1S/C15H20N2O2/c1-10(2)16-4-3-11-9-17-13-8-15-14(7-12(11)13)18-5-6-19-15/h7-10,16-17H,3-6H2,1-2H3
InChIKeyAPOMTRSWSSOBGY-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.48
Rot. Bonds4

About N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine

N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine (PubChem CID 82500566) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine.

Molecular Properties

Compound NameN-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine
PubChem CID82500566
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine
SMILESCC(C)NCCc1c[nH]c2cc3c(cc12)OCCO3
InChIInChI=1S/C15H20N2O2/c1-10(2)16-4-3-11-9-17-13-8-15-14(7-12(11)13)18-5-6-19-15/h7-10,16-17H,3-6H2,1-2H3
InChIKeyAPOMTRSWSSOBGY-UHFFFAOYSA-N
XLogP2.48
TPSA46.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine with MolForge

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Related Compounds

N-[2-(6-methyl-1H-indol-3-yl)ethyl]propan-2-amine
CID 82493176
2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)propan-1-amine
CID 82495727
5-(7-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-propan-2-ylpentan-1-amine
CID 65305532
(1R)-N-[2-(6-methyl-1H-indol-3-yl)ethyl]-1-(oxan-4-yl)ethanamine
CID 97231176
N-[2-(6-methyl-1H-indol-3-yl)ethyl]-1-(oxan-4-yl)ethanamine
CID 84587801
(Z)-but-2-enedioic acid;N-[2-(1H-indol-3-yl)ethyl]propan-2-amine
CID 5380391
N-[2-(1H-indol-3-yl)ethyl]-7-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 110763695
(2S)-1-cyclobutyl-N-[2-(6-fluoro-1H-indol-3-yl)ethyl]propan-2-amine
CID 171764220
N-[2-(1H-indol-3-yl)ethyl]-3-methylbutan-2-amine
CID 43202427
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(1H-indol-3-yl)ethyl]-2-methylpropanamide
CID 113197917
N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3-(1H-indol-3-yl)propanamide
CID 26193141
N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3-(1H-indol-3-yl)propanamide
CID 26193142

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine?
The IUPAC name of N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine (CID 82500566) is N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine.
What is the SMILES notation for N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine?
The canonical SMILES for N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine is CC(C)NCCc1c[nH]c2cc3c(cc12)OCCO3.
What is the InChIKey of N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine?
The InChIKey is APOMTRSWSSOBGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10(2)16-4-3-11-9-17-13-8-15-14(7-12(11)13)18-5-6-19-15/h7-10,16-17H,3-6H2,1-2H3.
What are the key properties of N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine?
N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine has a molecular weight of 260.34 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,6-dihydro-2H-[1,4]dioxino[2,3-f]indol-8-yl)ethyl]propan-2-amine is sourced from PubChem (CID 82500566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).