4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione

C14H16F2N2O2 — CID 164943118

IUPAC4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
SMILESCc1cc(C)c(=O)n2c1C(=O)NC21CCC(F)(F)CC1
InChIInChI=1S/C14H16F2N2O2/c1-8-7-9(2)12(20)18-10(8)11(19)17-14(18)5-3-13(15,16)4-6-14/h7H,3-6H2,1-2H3,(H,17,19)
InChIKeyBMBKHBIMWVCPLU-UHFFFAOYSA-N
MW282.29 g/mol
LogP2.07
Rot. Bonds

About 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione

4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione (PubChem CID 164943118) has the molecular formula C14H16F2N2O2 and a molecular weight of 282.29 g/mol. Its IUPAC name is 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione.

Molecular Properties

Compound Name4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
PubChem CID164943118
Molecular FormulaC14H16F2N2O2
Molecular Weight282.29 g/mol
Exact Mass282.12
IUPAC Name4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
SMILESCc1cc(C)c(=O)n2c1C(=O)NC21CCC(F)(F)CC1
InChIInChI=1S/C14H16F2N2O2/c1-8-7-9(2)12(20)18-10(8)11(19)17-14(18)5-3-13(15,16)4-6-14/h7H,3-6H2,1-2H3,(H,17,19)
InChIKeyBMBKHBIMWVCPLU-UHFFFAOYSA-N
XLogP2.07
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.29
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione with MolForge

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Related Compounds

6'-Bromo-4,4-difluoro-8'-methyl-2'H-spiro[cyclohexane-1,3'-imidazo[1,5-a]pyridine]-1',5'-dione
CID 118598972
6-amino-8-methyl-1'-(2,2,2-trifluoroethyl)spiro[2H-imidazo[1,5-a]pyridine-3,4'-piperidine]-1,5-dione
CID 132122257
6-amino-1'-(2,2-difluoroethyl)-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,4'-piperidine]-1,5-dione
CID 134382162
(Z,4Z)-4-(8,8-difluoro-4-methyl-2-oxo-1,4-diazaspiro[4.5]decan-3-ylidene)pent-2-enal
CID 135258960
4',4'-difluoro-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
CID 135259086
8-methyl-1'-(2,2,2-trifluoroethyl)spiro[2H-imidazo[1,5-a]pyridine-3,4'-piperidine]-1,5-dione
CID 144985924
8-chloro-4',4'-difluoro-6-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
CID 162572202
4',4'-difluoro-6-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
CID 164943114
8-fluoro-6-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
CID 164943120
4',4',8-trifluoro-6-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione
CID 164943130
tert-butyl N-(4',4'-difluoro-8-methyl-1,5-dioxospiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-6-yl)carbamate
CID 177932435
1',8-difluoro-1',6-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,4'-cyclohexane]-1,5-dione
CID 167571129

Frequently Asked Questions

What is the IUPAC name of 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
The IUPAC name of 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione (CID 164943118) is 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione.
What is the SMILES notation for 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
The canonical SMILES for 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione is Cc1cc(C)c(=O)n2c1C(=O)NC21CCC(F)(F)CC1.
What is the InChIKey of 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
The InChIKey is BMBKHBIMWVCPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2N2O2/c1-8-7-9(2)12(20)18-10(8)11(19)17-14(18)5-3-13(15,16)4-6-14/h7H,3-6H2,1-2H3,(H,17,19).
What are the key properties of 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione?
4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione has a molecular weight of 282.29 g/mol, XLogP of 2.07, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4',4'-difluoro-6,8-dimethylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclohexane]-1,5-dione is sourced from PubChem (CID 164943118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).