1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine

C15H21N3O — CID 115314840

IUPAC1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2c[nH]c3ccccc23)CCO1
InChIInChI=1S/C15H21N3O/c1-11(16)15-10-18(6-7-19-15)9-12-8-17-14-5-3-2-4-13(12)14/h2-5,8,11,15,17H,6-7,9-10,16H2,1H3
InChIKeyWBNPQFHKUQBAIO-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.72
Rot. Bonds3

About 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine

1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine (PubChem CID 115314840) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine
PubChem CID115314840
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine
SMILESCC(N)C1CN(Cc2c[nH]c3ccccc23)CCO1
InChIInChI=1S/C15H21N3O/c1-11(16)15-10-18(6-7-19-15)9-12-8-17-14-5-3-2-4-13(12)14/h2-5,8,11,15,17H,6-7,9-10,16H2,1H3
InChIKeyWBNPQFHKUQBAIO-UHFFFAOYSA-N
XLogP1.72
TPSA54.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(quinolin-4-ylmethyl)morpholin-2-yl]ethanamine
CID 115314848
(1S)-1-[(2S)-4-benzylmorpholin-2-yl]ethanamine
CID 95396414
2-[(4-fluorophenyl)methyl]-4-(1H-indol-3-ylmethyl)morpholine
CID 45209393
1-[4-[(2-nitrophenyl)methyl]morpholin-2-yl]ethanamine
CID 81490216
1-[4-[(1,3-dimethylindol-2-yl)methyl]morpholin-2-yl]ethanamine
CID 107236440
1-[4-[(4-fluorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81491103
N-[[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methyl]propan-2-amine
CID 63240913
2-[(2R)-4-(1H-indol-3-ylmethyl)-1-propan-2-ylpiperazin-2-yl]ethanol
CID 98579746
1-[4-[(5-bromofuran-2-yl)methyl]morpholin-2-yl]ethanamine
CID 115314919
1-[4-[(5-methylthiophen-2-yl)methyl]morpholin-2-yl]ethanamine
CID 115315061
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(1H-indol-3-ylmethyl)-N-(2-methylpropyl)morpholine-2-carboxamide
CID 57432163
1-[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]ethanamine
CID 81490139

Frequently Asked Questions

What is the IUPAC name of 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine?
The IUPAC name of 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine (CID 115314840) is 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine.
What is the SMILES notation for 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine?
The canonical SMILES for 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine is CC(N)C1CN(Cc2c[nH]c3ccccc23)CCO1.
What is the InChIKey of 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine?
The InChIKey is WBNPQFHKUQBAIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11(16)15-10-18(6-7-19-15)9-12-8-17-14-5-3-2-4-13(12)14/h2-5,8,11,15,17H,6-7,9-10,16H2,1H3.
What are the key properties of 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine?
1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine has a molecular weight of 259.35 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(1H-indol-3-ylmethyl)morpholin-2-yl]ethanamine is sourced from PubChem (CID 115314840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).