spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one

C11H12N2O — CID 90103164

IUPACspiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one
SMILESO=C1Nc2cnccc2C12CCCC2
InChIInChI=1S/C11H12N2O/c14-10-11(4-1-2-5-11)8-3-6-12-7-9(8)13-10/h3,6-7H,1-2,4-5H2,(H,13,14)
InChIKeyGOTDBVXVYHQCOX-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.85
Rot. Bonds

About spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one

spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one (PubChem CID 90103164) has the molecular formula C11H12N2O and a molecular weight of 188.23 g/mol. Its IUPAC name is spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one.

Molecular Properties

Compound Namespiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one
PubChem CID90103164
Molecular FormulaC11H12N2O
Molecular Weight188.23 g/mol
Exact Mass188.09
IUPAC Namespiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one
SMILESO=C1Nc2cnccc2C12CCCC2
InChIInChI=1S/C11H12N2O/c14-10-11(4-1-2-5-11)8-3-6-12-7-9(8)13-10/h3,6-7H,1-2,4-5H2,(H,13,14)
InChIKeyGOTDBVXVYHQCOX-UHFFFAOYSA-N
XLogP1.85
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one?
The IUPAC name of spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one (CID 90103164) is spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one.
What is the SMILES notation for spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one?
The canonical SMILES for spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one is O=C1Nc2cnccc2C12CCCC2.
What is the InChIKey of spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one?
The InChIKey is GOTDBVXVYHQCOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O/c14-10-11(4-1-2-5-11)8-3-6-12-7-9(8)13-10/h3,6-7H,1-2,4-5H2,(H,13,14).
What are the key properties of spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one?
spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one has a molecular weight of 188.23 g/mol, XLogP of 1.85, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1H-pyrrolo[2,3-c]pyridine-3,1'-cyclopentane]-2-one is sourced from PubChem (CID 90103164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).