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

C12H16N2O — CID 82190534

IUPAC7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one
SMILESCc1cc2c(c(CC(C)N)c1)NC(=O)C2
InChIInChI=1S/C12H16N2O/c1-7-3-9(5-8(2)13)12-10(4-7)6-11(15)14-12/h3-4,8H,5-6,13H2,1-2H3,(H,14,15)
InChIKeyJDHLDYRBYGLMPT-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.38
Rot. Bonds2

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

7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one (PubChem CID 82190534) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one
PubChem CID82190534
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one
SMILESCc1cc2c(c(CC(C)N)c1)NC(=O)C2
InChIInChI=1S/C12H16N2O/c1-7-3-9(5-8(2)13)12-10(4-7)6-11(15)14-12/h3-4,8H,5-6,13H2,1-2H3,(H,14,15)
InChIKeyJDHLDYRBYGLMPT-UHFFFAOYSA-N
XLogP1.38
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-ethyl-5-methyl-1,3-dihydroindol-2-one
CID 142337583
7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one
CID 82190531
7-[(1-hydroxycyclopropyl)methyl]-5-methyl-1,3-dihydroindol-2-one
CID 117309426
8-(2-aminopropyl)-6-bromo-3,4-dihydro-1H-quinolin-2-one
CID 82190811
5-[amino-(4-methylphenyl)methyl]-7-ethyl-1,3-dihydroindol-2-one
CID 82172898
7-(1-hydroxy-2,2-dimethylpropyl)-5-methyl-1,3-dihydroindol-2-one
CID 82172426
2-[1-(5-methyl-2-oxo-1,3-dihydroindol-7-yl)cyclopropyl]acetic acid
CID 117364760
1-(2,3,5-trimethylphenyl)propan-2-amine
CID 117277671
5-tert-butyl-7-ethyl-1,3-dihydroindol-2-one
CID 134457828
5-amino-7-(fluoromethyl)-1,3-dihydroindol-2-one
CID 69465620
7-(aminomethyl)-5-bromo-1,3-dihydroindol-2-one
CID 82190668
5-(2-aminoethyl)-6-chloro-7-methyl-1,3-dihydroindol-2-one
CID 82190727

Frequently Asked Questions

What is the IUPAC name of 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one?
The IUPAC name of 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one (CID 82190534) is 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one?
The canonical SMILES for 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one is Cc1cc2c(c(CC(C)N)c1)NC(=O)C2.
What is the InChIKey of 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one?
The InChIKey is JDHLDYRBYGLMPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-7-3-9(5-8(2)13)12-10(4-7)6-11(15)14-12/h3-4,8H,5-6,13H2,1-2H3,(H,14,15).
What are the key properties of 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one?
7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one has a molecular weight of 204.27 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 82190534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).