5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]

C15H21FN2 — CID 115097649

IUPAC5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
SMILESCC(C)N1c2c(F)cccc2NCC12CCCC2
InChIInChI=1S/C15H21FN2/c1-11(2)18-14-12(16)6-5-7-13(14)17-10-15(18)8-3-4-9-15/h5-7,11,17H,3-4,8-10H2,1-2H3
InChIKeyDWZJBVICXFHFGG-UHFFFAOYSA-N
MW248.34 g/mol
LogP3.78
Rot. Bonds1

About 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]

5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane] (PubChem CID 115097649) has the molecular formula C15H21FN2 and a molecular weight of 248.34 g/mol. Its IUPAC name is 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane].

Molecular Properties

Compound Name5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
PubChem CID115097649
Molecular FormulaC15H21FN2
Molecular Weight248.34 g/mol
Exact Mass248.17
IUPAC Name5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
SMILESCC(C)N1c2c(F)cccc2NCC12CCCC2
InChIInChI=1S/C15H21FN2/c1-11(2)18-14-12(16)6-5-7-13(14)17-10-15(18)8-3-4-9-15/h5-7,11,17H,3-4,8-10H2,1-2H3
InChIKeyDWZJBVICXFHFGG-UHFFFAOYSA-N
XLogP3.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.34
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane] with MolForge

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Related Compounds

5-methyl-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097965
5-fluoro-4-propan-2-ylspiro[1H-quinoxaline-3,1'-cyclopentane]-2-one
CID 115097635
7-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
CID 115097804
6-fluoro-5-methylspiro[2,4-dihydro-1H-1,5-benzodiazepine-3,1'-cyclopropane]
CID 115099075
4-methyl-5-(trifluoromethyl)spiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097937
5-bromo-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097943
8-fluoro-1-propan-2-yl-3,4-dihydroquinoxalin-2-one
CID 84621075
5-tert-butyl-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]
CID 84637531
5-methoxy-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115097947
4-propan-2-yl-6-(trifluoromethyl)spiro[1,2-dihydroquinoxaline-3,1'-cyclobutane]
CID 115097551
8-methoxy-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclohexane]
CID 115098056
5-methoxy-4-methylspiro[1,2-dihydroquinoxaline-3,1'-cyclobutane]
CID 115097269

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]?
The IUPAC name of 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane] (CID 115097649) is 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane].
What is the SMILES notation for 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]?
The canonical SMILES for 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane] is CC(C)N1c2c(F)cccc2NCC12CCCC2.
What is the InChIKey of 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]?
The InChIKey is DWZJBVICXFHFGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2/c1-11(2)18-14-12(16)6-5-7-13(14)17-10-15(18)8-3-4-9-15/h5-7,11,17H,3-4,8-10H2,1-2H3.
What are the key properties of 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane]?
5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane] has a molecular weight of 248.34 g/mol, XLogP of 3.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-propan-2-ylspiro[1,2-dihydroquinoxaline-3,1'-cyclopentane] is sourced from PubChem (CID 115097649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).