2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine

C14H20N2O — CID 102911958

IUPAC2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine
SMILESCCOC(C)CNCc1ccc2[nH]ccc2c1
InChIInChI=1S/C14H20N2O/c1-3-17-11(2)9-15-10-12-4-5-14-13(8-12)6-7-16-14/h4-8,11,15-16H,3,9-10H2,1-2H3
InChIKeyYBIZTGKXZYOVDW-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.68
Rot. Bonds6

About 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine

2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine (PubChem CID 102911958) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine
PubChem CID102911958
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine
SMILESCCOC(C)CNCc1ccc2[nH]ccc2c1
InChIInChI=1S/C14H20N2O/c1-3-17-11(2)9-15-10-12-4-5-14-13(8-12)6-7-16-14/h4-8,11,15-16H,3,9-10H2,1-2H3
InChIKeyYBIZTGKXZYOVDW-UHFFFAOYSA-N
XLogP2.68
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indol-5-ylmethyl)-2-methylsulfanylpropan-1-amine
CID 102911932
N-(1H-indol-5-ylmethyl)-2-propan-2-yloxyethanamine
CID 102911874
2-ethoxy-N-[(6-methoxynaphthalen-2-yl)methyl]propan-1-amine
CID 115655584
N-[(3,4-dibromophenyl)methyl]-2-ethoxypropan-1-amine
CID 115693242
N-[(3,4-dichlorophenyl)methyl]-2-ethoxypropan-1-amine
CID 115655535
N-(1H-indol-5-ylmethyl)-2-(2-methylpropoxy)ethanamine
CID 102912150
2-ethoxy-N-[(2-methylquinolin-6-yl)methyl]propan-1-amine
CID 105378678
N-(1H-indol-5-ylmethyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 102910856
N-[(4-bromo-3-methylphenyl)methyl]-2-ethoxypropan-1-amine
CID 115668244
methyl 4-[(1H-indol-5-ylmethylamino)methyl]benzoate
CID 118070071
N-(1H-indol-5-ylmethyl)but-2-yn-1-amine
CID 102911910
N-(1H-indol-5-ylmethyl)-1-(3-methoxyphenyl)methanamine
CID 17221716

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine?
The IUPAC name of 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine (CID 102911958) is 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine?
The canonical SMILES for 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine is CCOC(C)CNCc1ccc2[nH]ccc2c1.
What is the InChIKey of 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine?
The InChIKey is YBIZTGKXZYOVDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-17-11(2)9-15-10-12-4-5-14-13(8-12)6-7-16-14/h4-8,11,15-16H,3,9-10H2,1-2H3.
What are the key properties of 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine?
2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine has a molecular weight of 232.33 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(1H-indol-5-ylmethyl)propan-1-amine is sourced from PubChem (CID 102911958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).