5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one

C19H24N4O2 — CID 154755113

IUPAC5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one
SMILESCCc1noc(C2CCC(Nc3ccc4c(c3)CC(=O)N4C)CC2)n1
InChIInChI=1S/C19H24N4O2/c1-3-17-21-19(25-22-17)12-4-6-14(7-5-12)20-15-8-9-16-13(10-15)11-18(24)23(16)2/h8-10,12,14,20H,3-7,11H2,1-2H3
InChIKeyCINADLMNLIRSSN-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.29
Rot. Bonds4

About 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one

5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one (PubChem CID 154755113) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one.

Molecular Properties

Compound Name5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one
PubChem CID154755113
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one
SMILESCCc1noc(C2CCC(Nc3ccc4c(c3)CC(=O)N4C)CC2)n1
InChIInChI=1S/C19H24N4O2/c1-3-17-21-19(25-22-17)12-4-6-14(7-5-12)20-15-8-9-16-13(10-15)11-18(24)23(16)2/h8-10,12,14,20H,3-7,11H2,1-2H3
InChIKeyCINADLMNLIRSSN-UHFFFAOYSA-N
XLogP3.29
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one with MolForge

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Related Compounds

5-[(4-hydroxycyclohexyl)amino]-1-methyl-3H-indol-2-one
CID 115149338
2-[[5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-2-pyridinyl]oxy]ethanol
CID 110013550
1-methyl-5-[4-(methylamino)cyclohexyl]-3H-indol-2-one
CID 116962667
5-[(2-aminocyclohexyl)amino]-1-methyl-3H-indol-2-one
CID 115117780
5-(hydroxymethylamino)-1-methyl-3H-indol-2-one
CID 115228674
4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine
CID 60812048
(4S)-4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1-(4-fluoro-2-methylphenyl)pyrrolidin-2-one
CID 93492773
[2-[[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]methyl]phenyl]methanol
CID 110013138
ethyl N-(1-methyl-2-oxo-3H-indol-5-yl)carbamate
CID 40805083
2-[[6-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-3-pyridinyl]-methylamino]ethanol
CID 110013500
N-(1-methyl-2-oxo-3H-indol-5-yl)carbamoyl bromide
CID 115193255
N-(1-methyl-2-oxo-3H-indol-5-yl)carbamoyl chloride
CID 115194357

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one?
The IUPAC name of 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one (CID 154755113) is 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one.
What is the SMILES notation for 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one?
The canonical SMILES for 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one is CCc1noc(C2CCC(Nc3ccc4c(c3)CC(=O)N4C)CC2)n1.
What is the InChIKey of 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one?
The InChIKey is CINADLMNLIRSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-3-17-21-19(25-22-17)12-4-6-14(7-5-12)20-15-8-9-16-13(10-15)11-18(24)23(16)2/h8-10,12,14,20H,3-7,11H2,1-2H3.
What are the key properties of 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one?
5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one has a molecular weight of 340.43 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(3-ethyl-1,2,4-oxadiazol-5-yl)cyclohexyl]amino]-1-methyl-3H-indol-2-one is sourced from PubChem (CID 154755113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).