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

C15H21N3O — CID 126578251

IUPAC2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine
SMILESNCCn1c(CN2CCOCC2)cc2ccccc21
InChIInChI=1S/C15H21N3O/c16-5-6-18-14(12-17-7-9-19-10-8-17)11-13-3-1-2-4-15(13)18/h1-4,11H,5-10,12,16H2
InChIKeyCCOJAFVOYISWKI-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.43
Rot. Bonds4

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

2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine (PubChem CID 126578251) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine
PubChem CID126578251
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine
SMILESNCCn1c(CN2CCOCC2)cc2ccccc21
InChIInChI=1S/C15H21N3O/c16-5-6-18-14(12-17-7-9-19-10-8-17)11-13-3-1-2-4-15(13)18/h1-4,11H,5-10,12,16H2
InChIKeyCCOJAFVOYISWKI-UHFFFAOYSA-N
XLogP1.43
TPSA43.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(1-methylindol-2-yl)methyl]morpholine
CID 117173146
1-ethyl-2-(morpholin-4-ylmethyl)indol-5-amine
CID 117177153
1-ethyl-2-(morpholin-4-ylmethyl)indol-6-ol
CID 117180604
2-[5-methyl-2-(morpholin-4-ylmethyl)benzimidazol-1-yl]ethanamine
CID 82310629
1-methyl-2-(morpholin-4-ylmethyl)indol-5-amine
CID 117176639
4-[(7-fluoro-1-propan-2-ylindol-2-yl)methyl]morpholine
CID 117184085
3-(morpholin-4-ylmethyl)naphthalen-2-amine
CID 61214111
[1-[[1-[(3-chlorophenyl)methyl]indol-2-yl]methyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 50807615
10-(anthracen-9-ylmethyl)-1,4,7-trioxa-10-azacyclododecane
CID 101025185
4-[(1-methylindol-3-yl)methyl]morpholine
CID 15496284
[1-(2-morpholin-4-ylethyl)indol-3-yl]methanamine
CID 66407723
4-(hydroxymethyl)-1-[(1-methylindol-2-yl)methyl]azepan-4-ol
CID 74236763

Frequently Asked Questions

What is the IUPAC name of 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine?
The IUPAC name of 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine (CID 126578251) is 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine.
What is the SMILES notation for 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine?
The canonical SMILES for 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine is NCCn1c(CN2CCOCC2)cc2ccccc21.
What is the InChIKey of 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine?
The InChIKey is CCOJAFVOYISWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c16-5-6-18-14(12-17-7-9-19-10-8-17)11-13-3-1-2-4-15(13)18/h1-4,11H,5-10,12,16H2.
What are the key properties of 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine?
2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine has a molecular weight of 259.35 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(morpholin-4-ylmethyl)indol-1-yl]ethanamine is sourced from PubChem (CID 126578251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).