5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one

C14H20N2O — CID 82190504

IUPAC5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one
SMILESCCC1C(=O)Nc2c(C)cc(CC(C)N)cc21
InChIInChI=1S/C14H20N2O/c1-4-11-12-7-10(6-9(3)15)5-8(2)13(12)16-14(11)17/h5,7,9,11H,4,6,15H2,1-3H3,(H,16,17)
InChIKeyFHVPBXLDXUWDDB-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.33
Rot. Bonds3

About 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one

5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one (PubChem CID 82190504) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one
PubChem CID82190504
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one
SMILESCCC1C(=O)Nc2c(C)cc(CC(C)N)cc21
InChIInChI=1S/C14H20N2O/c1-4-11-12-7-10(6-9(3)15)5-8(2)13(12)16-14(11)17/h5,7,9,11H,4,6,15H2,1-3H3,(H,16,17)
InChIKeyFHVPBXLDXUWDDB-UHFFFAOYSA-N
XLogP2.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-(1-aminoethyl)-3-ethyl-6,7-dimethyl-1,3-dihydroindol-2-one
CID 82173119
7-[amino-(2-methylphenyl)methyl]-3,5-diethyl-1,3-dihydroindol-2-one
CID 82172664
7-[amino-(3-methylphenyl)methyl]-3,5-diethyl-1,3-dihydroindol-2-one
CID 82172665
7-[amino-(4-methylphenyl)methyl]-3,5-diethyl-1,3-dihydroindol-2-one
CID 82172666
5-(1-amino-2-methylpropyl)-3,7-diethyl-1,3-dihydroindol-2-one
CID 82172974
3,5-diethyl-7-(1-hydroxybutyl)-1,3-dihydroindol-2-one
CID 82172672
5-(2-aminoethyl)-7-chloro-3-ethyl-1,3-dihydroindol-2-one
CID 82190581
7-(2-chloropropanoyl)-3,5-diethyl-1,3-dihydroindol-2-one
CID 82104825
3-ethyl-5-(1-hydroxy-2-methylpropyl)-6,7-dimethyl-1,3-dihydroindol-2-one
CID 82173135
7-(aminomethyl)-5-chloro-3-ethyl-1,3-dihydroindol-2-one
CID 82190658
3-ethyl-5-[(2-fluorophenyl)-hydroxymethyl]-7-methyl-1,3-dihydroindol-2-one
CID 82172845
2-(2-aminopropyl)-5-ethyl-1H-pyrimidine-4,6-dione
CID 76998275

Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one?
The IUPAC name of 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one (CID 82190504) is 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one is CCC1C(=O)Nc2c(C)cc(CC(C)N)cc21.
What is the InChIKey of 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one?
The InChIKey is FHVPBXLDXUWDDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-4-11-12-7-10(6-9(3)15)5-8(2)13(12)16-14(11)17/h5,7,9,11H,4,6,15H2,1-3H3,(H,16,17).
What are the key properties of 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one?
5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one has a molecular weight of 232.33 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopropyl)-3-ethyl-7-methyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 82190504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).