6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one

C16H16N2O2 — CID 66915592

IUPAC6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one
SMILESCOc1ccc2c(c1)C(=O)CC21CCCc2cncn21
InChIInChI=1S/C16H16N2O2/c1-20-12-4-5-14-13(7-12)15(19)8-16(14)6-2-3-11-9-17-10-18(11)16/h4-5,7,9-10H,2-3,6,8H2,1H3
InChIKeyFLNQUMGSAXGWRF-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.56
Rot. Bonds1

About 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one

6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one (PubChem CID 66915592) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one.

Molecular Properties

Compound Name6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one
PubChem CID66915592
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one
SMILESCOc1ccc2c(c1)C(=O)CC21CCCc2cncn21
InChIInChI=1S/C16H16N2O2/c1-20-12-4-5-14-13(7-12)15(19)8-16(14)6-2-3-11-9-17-10-18(11)16/h4-5,7,9-10H,2-3,6,8H2,1H3
InChIKeyFLNQUMGSAXGWRF-UHFFFAOYSA-N
XLogP2.56
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one?
The IUPAC name of 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one (CID 66915592) is 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one.
What is the SMILES notation for 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one?
The canonical SMILES for 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one is COc1ccc2c(c1)C(=O)CC21CCCc2cncn21.
What is the InChIKey of 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one?
The InChIKey is FLNQUMGSAXGWRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-20-12-4-5-14-13(7-12)15(19)8-16(14)6-2-3-11-9-17-10-18(11)16/h4-5,7,9-10H,2-3,6,8H2,1H3.
What are the key properties of 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one?
6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one has a molecular weight of 268.32 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxyspiro[2H-indene-3,5'-7,8-dihydro-6H-imidazo[1,5-a]pyridine]-1-one is sourced from PubChem (CID 66915592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).