spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one

C9H10N2O — CID 175842879

IUPACspiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one
SMILESO=C1NCC2(CC2)c2[nH]ccc21
InChIInChI=1S/C9H10N2O/c12-8-6-1-4-10-7(6)9(2-3-9)5-11-8/h1,4,10H,2-3,5H2,(H,11,12)
InChIKeyYHQQXWOEVFHYEB-UHFFFAOYSA-N
MW162.19 g/mol
LogP0.79
Rot. Bonds

About spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one

spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one (PubChem CID 175842879) has the molecular formula C9H10N2O and a molecular weight of 162.19 g/mol. Its IUPAC name is spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one.

Molecular Properties

Compound Namespiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one
PubChem CID175842879
Molecular FormulaC9H10N2O
Molecular Weight162.19 g/mol
Exact Mass162.08
IUPAC Namespiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one
SMILESO=C1NCC2(CC2)c2[nH]ccc21
InChIInChI=1S/C9H10N2O/c12-8-6-1-4-10-7(6)9(2-3-9)5-11-8/h1,4,10H,2-3,5H2,(H,11,12)
InChIKeyYHQQXWOEVFHYEB-UHFFFAOYSA-N
XLogP0.79
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one?
The IUPAC name of spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one (CID 175842879) is spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one.
What is the SMILES notation for spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one?
The canonical SMILES for spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one is O=C1NCC2(CC2)c2[nH]ccc21.
What is the InChIKey of spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one?
The InChIKey is YHQQXWOEVFHYEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O/c12-8-6-1-4-10-7(6)9(2-3-9)5-11-8/h1,4,10H,2-3,5H2,(H,11,12).
What are the key properties of spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one?
spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one has a molecular weight of 162.19 g/mol, XLogP of 0.79, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[5,6-dihydro-1H-pyrrolo[3,2-c]pyridine-7,1'-cyclopropane]-4-one is sourced from PubChem (CID 175842879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).