2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone

C17H20N4O3 — CID 110634505

IUPAC2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone
SMILESCc1nc(CC(=O)N2CCc3ccc(N4CCOCC4)cc32)no1
InChIInChI=1S/C17H20N4O3/c1-12-18-16(19-24-12)11-17(22)21-5-4-13-2-3-14(10-15(13)21)20-6-8-23-9-7-20/h2-3,10H,4-9,11H2,1H3
InChIKeyXTBZOKBRMWCLNH-UHFFFAOYSA-N
MW328.37 g/mol
LogP1.35
Rot. Bonds3

About 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone

2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone (PubChem CID 110634505) has the molecular formula C17H20N4O3 and a molecular weight of 328.37 g/mol. Its IUPAC name is 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone.

Molecular Properties

Compound Name2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone
PubChem CID110634505
Molecular FormulaC17H20N4O3
Molecular Weight328.37 g/mol
Exact Mass328.15
IUPAC Name2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone
SMILESCc1nc(CC(=O)N2CCc3ccc(N4CCOCC4)cc32)no1
InChIInChI=1S/C17H20N4O3/c1-12-18-16(19-24-12)11-17(22)21-5-4-13-2-3-14(10-15(13)21)20-6-8-23-9-7-20/h2-3,10H,4-9,11H2,1H3
InChIKeyXTBZOKBRMWCLNH-UHFFFAOYSA-N
XLogP1.35
TPSA71.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-morpholin-4-ylphenyl)-1-(6-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)ethanone
CID 110634411
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-(3-morpholin-4-ylphenyl)acetamide
CID 110612977
1-(4-methoxyphenyl)-4-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)butane-1,4-dione
CID 110634495
N-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110606103
(6-morpholin-4-yl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 110316076
1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)-4-phenoxybutan-1-one
CID 110316103
1-(5-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone
CID 71684022
N-[3-(5-morpholin-4-yl-2,3-dihydroindol-1-yl)-3-oxopropyl]acetamide
CID 110355069
2-(3,4-dimethoxyphenyl)-1-(5-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone
CID 110316227
(3-tert-butyl-5-methyl-1,2-oxazol-4-yl)-(5-morpholin-4-yl-2,3-dihydroindol-1-yl)methanone
CID 110634555
N-(1-acetyl-2,3-dihydroindol-6-yl)-2-(4-morpholin-4-ylphenyl)acetamide
CID 110627232
N-[2-(2-methoxyphenyl)ethyl]-6-morpholin-4-yl-2,3-dihydroindole-1-carboxamide
CID 110634499

Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone?
The IUPAC name of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone (CID 110634505) is 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone.
What is the SMILES notation for 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone?
The canonical SMILES for 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone is Cc1nc(CC(=O)N2CCc3ccc(N4CCOCC4)cc32)no1.
What is the InChIKey of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone?
The InChIKey is XTBZOKBRMWCLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O3/c1-12-18-16(19-24-12)11-17(22)21-5-4-13-2-3-14(10-15(13)21)20-6-8-23-9-7-20/h2-3,10H,4-9,11H2,1H3.
What are the key properties of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone?
2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone has a molecular weight of 328.37 g/mol, XLogP of 1.35, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,2,4-oxadiazol-3-yl)-1-(6-morpholin-4-yl-2,3-dihydroindol-1-yl)ethanone is sourced from PubChem (CID 110634505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).