N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine

C17H26N2 — CID 82925492

IUPACN-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine
SMILESCCNCc1ccc2c(ccn2CC(CC)CC)c1
InChIInChI=1S/C17H26N2/c1-4-14(5-2)13-19-10-9-16-11-15(12-18-6-3)7-8-17(16)19/h7-11,14,18H,4-6,12-13H2,1-3H3
InChIKeySQRIQLWLDXCGIY-UHFFFAOYSA-N
MW258.41 g/mol
LogP4.19
Rot. Bonds7

About N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine

N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine (PubChem CID 82925492) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine
PubChem CID82925492
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine
SMILESCCNCc1ccc2c(ccn2CC(CC)CC)c1
InChIInChI=1S/C17H26N2/c1-4-14(5-2)13-19-10-9-16-11-15(12-18-6-3)7-8-17(16)19/h7-11,14,18H,4-6,12-13H2,1-3H3
InChIKeySQRIQLWLDXCGIY-UHFFFAOYSA-N
XLogP4.19
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[5-(ethylaminomethyl)indol-1-yl]propane-1,2-diol
CID 102915922
2-[5-(ethylaminomethyl)indol-1-yl]ethanol
CID 102915827
3-[5-(ethylaminomethyl)indol-1-yl]propan-1-ol
CID 102915831
2-[5-(ethylaminomethyl)indol-1-yl]acetonitrile
CID 102915930
1-[1-(2-ethylbutyl)indol-6-yl]-N-methylmethanamine
CID 82924593
methyl 2-[5-(ethylaminomethyl)indol-1-yl]acetate
CID 102915843
N-[[1-(2-ethylsulfanylethyl)indol-5-yl]methyl]ethanamine
CID 113474442
N-ethyl-2-[5-(ethylaminomethyl)indol-1-yl]acetamide
CID 102915889
N-[[1-(3-methoxy-3-methylbutyl)indol-5-yl]methyl]ethanamine
CID 103035023
2-methyl-3-[5-[(2-methylpropylamino)methyl]indol-1-yl]propan-1-ol
CID 102916325
N-[[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]indol-5-yl]methyl]ethanamine
CID 102915939
N-[[1-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]indol-5-yl]methyl]ethanamine
CID 102915853

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine?
The IUPAC name of N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine (CID 82925492) is N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine is CCNCc1ccc2c(ccn2CC(CC)CC)c1.
What is the InChIKey of N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine?
The InChIKey is SQRIQLWLDXCGIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-4-14(5-2)13-19-10-9-16-11-15(12-18-6-3)7-8-17(16)19/h7-11,14,18H,4-6,12-13H2,1-3H3.
What are the key properties of N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine?
N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine has a molecular weight of 258.41 g/mol, XLogP of 4.19, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-ethylbutyl)indol-5-yl]methyl]ethanamine is sourced from PubChem (CID 82925492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).