N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine

C15H20N2O — CID 67231451

IUPACN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine
SMILESCOc1ccc2[nH]cc(CCN(C)C3CC3)c2c1
InChIInChI=1S/C15H20N2O/c1-17(12-3-4-12)8-7-11-10-16-15-6-5-13(18-2)9-14(11)15/h5-6,9-10,12,16H,3-4,7-8H2,1-2H3
InChIKeyQPWOQPVEFMCNDX-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.81
Rot. Bonds5

About N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine (PubChem CID 67231451) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine.

Molecular Properties

Compound NameN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine
PubChem CID67231451
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine
SMILESCOc1ccc2[nH]cc(CCN(C)C3CC3)c2c1
InChIInChI=1S/C15H20N2O/c1-17(12-3-4-12)8-7-11-10-16-15-6-5-13(18-2)9-14(11)15/h5-6,9-10,12,16H,3-4,7-8H2,1-2H3
InChIKeyQPWOQPVEFMCNDX-UHFFFAOYSA-N
XLogP2.81
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylacetamide
CID 22367215
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrochloride
CID 24802109
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-propan-2-ylpropan-2-amine;hydrate;hydrochloride
CID 71311787
3-(2-cyclohexylethyl)-5-methoxy-1H-indole
CID 106985417
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 74405227
2-[[3-[2-[cyclopropyl(methyl)amino]ethyl]-1H-indol-5-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
CID 169222271
2,2,2-trifluoro-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-(2,2,2-trifluoroethyl)ethanamine
CID 172624963
N-hydroxy-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
CID 22144617
3-[2-(2,4-dimethylazetidin-1-yl)ethyl]-5-methoxy-1H-indole
CID 170277434
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-5-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)-2-propan-2-ylcyclohexan-1-amine
CID 174722109
5-methoxy-3-(3,3,3-trifluoropropyl)-1H-indole
CID 102104245
3-(2-ethoxyethyl)-5-methoxy-1H-indole
CID 167475271

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine?
The IUPAC name of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine (CID 67231451) is N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine.
What is the SMILES notation for N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine?
The canonical SMILES for N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine is COc1ccc2[nH]cc(CCN(C)C3CC3)c2c1.
What is the InChIKey of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine?
The InChIKey is QPWOQPVEFMCNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-17(12-3-4-12)8-7-11-10-16-15-6-5-13(18-2)9-14(11)15/h5-6,9-10,12,16H,3-4,7-8H2,1-2H3.
What are the key properties of N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine?
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine has a molecular weight of 244.34 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylcyclopropanamine is sourced from PubChem (CID 67231451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).