2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine

C15H21N3O — CID 82301212

IUPAC2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine
SMILESCc1[nH]c2ccccc2c1C(CN)N1CCOCC1
InChIInChI=1S/C15H21N3O/c1-11-15(12-4-2-3-5-13(12)17-11)14(10-16)18-6-8-19-9-7-18/h2-5,14,17H,6-10,16H2,1H3
InChIKeyYXQQVDSJJRZOTA-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.81
Rot. Bonds3

About 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine

2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine (PubChem CID 82301212) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine.

Molecular Properties

Compound Name2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine
PubChem CID82301212
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine
SMILESCc1[nH]c2ccccc2c1C(CN)N1CCOCC1
InChIInChI=1S/C15H21N3O/c1-11-15(12-4-2-3-5-13(12)17-11)14(10-16)18-6-8-19-9-7-18/h2-5,14,17H,6-10,16H2,1H3
InChIKeyYXQQVDSJJRZOTA-UHFFFAOYSA-N
XLogP1.81
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 ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

4-[2-methyl-1-(2-methyl-1H-indol-3-yl)propyl]morpholine
CID 134844207
ethyl 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylacetate
CID 71490363
4-[(S)-(2-methyl-1H-indol-3-yl)-thiophen-2-ylmethyl]morpholine
CID 696739
4-[(S)-(2-methyl-1H-indol-3-yl)-pyridin-4-ylmethyl]morpholine
CID 729468
(1S)-1-(2-methyl-1H-indol-3-yl)ethane-1,2-diamine
CID 131198811
N-[(2-methyl-1H-indol-3-yl)methyl]-2-morpholin-4-yl-2-thiophen-2-ylethanamine
CID 17463435
1-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanone
CID 718235
2-methyl-3-[(1R)-1-piperazin-1-ylhexyl]-1H-indole
CID 171307913
(2R)-2-(2,6-difluorophenyl)-2-morpholin-4-ylethanamine
CID 30115194
2-(2-ethylphenyl)-2-morpholin-4-ylethanamine
CID 62392799
9H-carbazole;4-methylmorpholine
CID 175233361
2-(1,4-oxazepan-4-yl)-2-(2,4,6-trimethylphenyl)ethanamine
CID 62988305

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine?
The IUPAC name of 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine (CID 82301212) is 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine.
What is the SMILES notation for 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine?
The canonical SMILES for 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine is Cc1[nH]c2ccccc2c1C(CN)N1CCOCC1.
What is the InChIKey of 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine?
The InChIKey is YXQQVDSJJRZOTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-11-15(12-4-2-3-5-13(12)17-11)14(10-16)18-6-8-19-9-7-18/h2-5,14,17H,6-10,16H2,1H3.
What are the key properties of 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine?
2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine has a molecular weight of 259.35 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-1H-indol-3-yl)-2-morpholin-4-ylethanamine is sourced from PubChem (CID 82301212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).