8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione

C18H20N4O2 — CID 162649518

IUPAC8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
SMILESCc1cc(Nc2ccccn2)c(=O)n2c1C(=O)NC21CCCCC1
InChIInChI=1S/C18H20N4O2/c1-12-11-13(20-14-7-3-6-10-19-14)17(24)22-15(12)16(23)21-18(22)8-4-2-5-9-18/h3,6-7,10-11H,2,4-5,8-9H2,1H3,(H,19,20)(H,21,23)
InChIKeyPFGCLVKFYHNLOX-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.66
Rot. Bonds2

About 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione

8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione (PubChem CID 162649518) has the molecular formula C18H20N4O2 and a molecular weight of 324.38 g/mol. Its IUPAC name is 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione.

Molecular Properties

Compound Name8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
PubChem CID162649518
Molecular FormulaC18H20N4O2
Molecular Weight324.38 g/mol
Exact Mass324.16
IUPAC Name8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
SMILESCc1cc(Nc2ccccn2)c(=O)n2c1C(=O)NC21CCCCC1
InChIInChI=1S/C18H20N4O2/c1-12-11-13(20-14-7-3-6-10-19-14)17(24)22-15(12)16(23)21-18(22)8-4-2-5-9-18/h3,6-7,10-11H,2,4-5,8-9H2,1H3,(H,19,20)(H,21,23)
InChIKeyPFGCLVKFYHNLOX-UHFFFAOYSA-N
XLogP2.66
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione 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 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
The IUPAC name of 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione (CID 162649518) is 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione.
What is the SMILES notation for 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
The canonical SMILES for 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione is Cc1cc(Nc2ccccn2)c(=O)n2c1C(=O)NC21CCCCC1.
What is the InChIKey of 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
The InChIKey is PFGCLVKFYHNLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2/c1-12-11-13(20-14-7-3-6-10-19-14)17(24)22-15(12)16(23)21-18(22)8-4-2-5-9-18/h3,6-7,10-11H,2,4-5,8-9H2,1H3,(H,19,20)(H,21,23).
What are the key properties of 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione has a molecular weight of 324.38 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-6-(pyridin-2-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione is sourced from PubChem (CID 162649518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).