2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide

C16H21N3O3 — CID 110642768

IUPAC2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NOCCN1CCOCC1
InChIInChI=1S/C16H21N3O3/c20-16(18-22-10-7-19-5-8-21-9-6-19)11-13-12-17-15-4-2-1-3-14(13)15/h1-4,12,17H,5-11H2,(H,18,20)
InChIKeyVMRBQAJIPHWFQM-UHFFFAOYSA-N
MW303.36 g/mol
LogP1.09
Rot. Bonds6

About 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide

2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide (PubChem CID 110642768) has the molecular formula C16H21N3O3 and a molecular weight of 303.36 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide
PubChem CID110642768
Molecular FormulaC16H21N3O3
Molecular Weight303.36 g/mol
Exact Mass303.16
IUPAC Name2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NOCCN1CCOCC1
InChIInChI=1S/C16H21N3O3/c20-16(18-22-10-7-19-5-8-21-9-6-19)11-13-12-17-15-4-2-1-3-14(13)15/h1-4,12,17H,5-11H2,(H,18,20)
InChIKeyVMRBQAJIPHWFQM-UHFFFAOYSA-N
XLogP1.09
TPSA66.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(1H-indol-3-yl)-1-[4-(2-morpholin-4-ylethyl)piperazin-1-yl]ethanone
CID 113073681
2-[[(4R)-4-amino-5-(2-morpholin-4-ylethoxy)-5-oxopentanoyl]amino]-3-(1H-indol-3-yl)propanoic acid
CID 66550735
1-[2-(1H-indol-3-yl)ethyl]-3-(2-morpholin-4-ylethyl)urea
CID 108988276
N-[2-(1H-indol-3-yl)ethyl]-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105921
N'-[2-(1H-indol-3-yl)ethyl]-N-(3-morpholin-4-ylpropyl)oxamide
CID 44902823
[2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]-2-oxoethyl] 1H-indole-3-carboxylate
CID 30755132
1-(1H-indol-3-ylmethyl)-N-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-2-carboxamide
CID 91955773
2-(1H-indol-3-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]acetamide
CID 55602446
2-(1H-indol-3-yl)-N-[(2-morpholin-4-yl-3-pyridinyl)methyl]acetamide
CID 25479539
1-(1H-indol-3-yl)-3-(2-morpholin-4-ylethyl)urea
CID 7615967
1-(1H-indol-3-ylmethyl)-N-(3-morpholin-4-ylpropyl)-5-oxopyrrolidine-2-carboxamide
CID 91955824
N-cyclopentyloxy-2-(1H-indol-3-yl)acetamide
CID 83202752

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide (CID 110642768) is 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide is O=C(Cc1c[nH]c2ccccc12)NOCCN1CCOCC1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide?
The InChIKey is VMRBQAJIPHWFQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O3/c20-16(18-22-10-7-19-5-8-21-9-6-19)11-13-12-17-15-4-2-1-3-14(13)15/h1-4,12,17H,5-11H2,(H,18,20).
What are the key properties of 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide?
2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide has a molecular weight of 303.36 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-(2-morpholin-4-ylethoxy)acetamide is sourced from PubChem (CID 110642768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).