4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one

C11H11N3O — CID 168942784

IUPAC4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one
SMILESCCn1c2ccccc2c2[nH][nH]c(=O)c21
InChIInChI=1S/C11H11N3O/c1-2-14-8-6-4-3-5-7(8)9-10(14)11(15)13-12-9/h3-6H,2H2,1H3,(H2,12,13,15)
InChIKeyMGMGFYKQYUWRTA-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.83
Rot. Bonds1

About 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one

4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one (PubChem CID 168942784) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one.

Molecular Properties

Compound Name4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one
PubChem CID168942784
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one
SMILESCCn1c2ccccc2c2[nH][nH]c(=O)c21
InChIInChI=1S/C11H11N3O/c1-2-14-8-6-4-3-5-7(8)9-10(14)11(15)13-12-9/h3-6H,2H2,1H3,(H2,12,13,15)
InChIKeyMGMGFYKQYUWRTA-UHFFFAOYSA-N
XLogP1.83
TPSA53.58 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one?
The IUPAC name of 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one (CID 168942784) is 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one.
What is the SMILES notation for 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one?
The canonical SMILES for 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one is CCn1c2ccccc2c2[nH][nH]c(=O)c21.
What is the InChIKey of 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one?
The InChIKey is MGMGFYKQYUWRTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-2-14-8-6-4-3-5-7(8)9-10(14)11(15)13-12-9/h3-6H,2H2,1H3,(H2,12,13,15).
What are the key properties of 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one?
4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one has a molecular weight of 201.23 g/mol, XLogP of 1.83, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,2-dihydropyrazolo[4,3-b]indol-3-one is sourced from PubChem (CID 168942784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).