5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one

C17H26N2O — CID 43484784

IUPAC5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one
SMILESCCCCC(CC)C(NC)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C17H26N2O/c1-4-6-7-12(5-2)17(18-3)13-8-9-15-14(10-13)11-16(20)19-15/h8-10,12,17-18H,4-7,11H2,1-3H3,(H,19,20)
InChIKeyMYHWXMUETKCJDA-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.66
Rot. Bonds7

About 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one

5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one (PubChem CID 43484784) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one
PubChem CID43484784
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one
SMILESCCCCC(CC)C(NC)c1ccc2c(c1)CC(=O)N2
InChIInChI=1S/C17H26N2O/c1-4-6-7-12(5-2)17(18-3)13-8-9-15-14(10-13)11-16(20)19-15/h8-10,12,17-18H,4-7,11H2,1-3H3,(H,19,20)
InChIKeyMYHWXMUETKCJDA-UHFFFAOYSA-N
XLogP3.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[2-(hydroxymethyl)-1-(methylamino)butyl]-1,3-dihydroindol-2-one
CID 116959878
5-(1-bromodecyl)-1,3-dihydroindol-2-one
CID 65428909
5-[4-amino-1-(methylamino)butyl]-1,3-dihydroindol-2-one
CID 116949295
6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one
CID 43483892
5-[4-hydroxy-1-(methylamino)butyl]-1,3-dihydroindol-2-one
CID 116952949
2-methyl-3-(methylamino)-3-(2-oxo-1,3-dihydroindol-5-yl)propanoic acid
CID 116953331
5-[3-amino-2,2-dimethyl-1-(methylamino)propyl]-1,3-dihydroindol-2-one
CID 116949019
1-(3,4-dichlorophenyl)-2-ethyl-N-methylhexan-1-amine
CID 43486466
2-(methylamino)-2-(2-oxo-1,3-dihydroindol-5-yl)acetonitrile
CID 116955002
5-[1-amino-2-(methylamino)ethyl]-1,3-dihydroindol-2-one
CID 116932458
5-[2,2,3,3-tetrafluoro-1-(methylamino)propyl]-1,3-dihydroindol-2-one
CID 79660978
methane;5-propan-2-yl-1,3-dihydroindol-2-one
CID 160830162

Frequently Asked Questions

What is the IUPAC name of 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one?
The IUPAC name of 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one (CID 43484784) is 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one?
The canonical SMILES for 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one is CCCCC(CC)C(NC)c1ccc2c(c1)CC(=O)N2.
What is the InChIKey of 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one?
The InChIKey is MYHWXMUETKCJDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-6-7-12(5-2)17(18-3)13-8-9-15-14(10-13)11-16(20)19-15/h8-10,12,17-18H,4-7,11H2,1-3H3,(H,19,20).
What are the key properties of 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one?
5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one has a molecular weight of 274.41 g/mol, XLogP of 3.66, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one is sourced from PubChem (CID 43484784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).