4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one

C18H25FN2O — CID 67986626

IUPAC4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one
SMILESCC(C)N1CCC2(CC1)C(=O)N(C)CC2c1ccc(F)cc1
InChIInChI=1S/C18H25FN2O/c1-13(2)21-10-8-18(9-11-21)16(12-20(3)17(18)22)14-4-6-15(19)7-5-14/h4-7,13,16H,8-12H2,1-3H3
InChIKeyRWRDOQREEQDGMP-UHFFFAOYSA-N
MW304.41 g/mol
LogP2.87
Rot. Bonds2

About 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one

4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one (PubChem CID 67986626) has the molecular formula C18H25FN2O and a molecular weight of 304.41 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one
PubChem CID67986626
Molecular FormulaC18H25FN2O
Molecular Weight304.41 g/mol
Exact Mass304.20
IUPAC Name4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one
SMILESCC(C)N1CCC2(CC1)C(=O)N(C)CC2c1ccc(F)cc1
InChIInChI=1S/C18H25FN2O/c1-13(2)21-10-8-18(9-11-21)16(12-20(3)17(18)22)14-4-6-15(19)7-5-14/h4-7,13,16H,8-12H2,1-3H3
InChIKeyRWRDOQREEQDGMP-UHFFFAOYSA-N
XLogP2.87
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.41
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(4-fluorophenyl)-1-propan-2-ylpyrrolidine
CID 166826823
(3R,4S)-3-(4-fluorophenyl)-4-methyl-1-propan-2-ylpyrrolidine
CID 58601309
4-(4-fluorophenyl)-8-(2-methylpentyl)-2,8-diazaspiro[4.5]decan-1-one
CID 123813920
3-methyl-8-propan-2-yl-1,3,8-triazaspiro[4.5]decan-4-one
CID 59128621
(2R)-4,4-difluoro-2-(4-fluorophenyl)-1-propan-2-ylpiperidine
CID 155148305
4-[(4-fluorophenyl)methyl]-1-propan-2-ylpiperidin-4-ol
CID 60895688
2-fluoro-5-methyl-N-[(2R)-3-methyl-1-(2-methyl-1-oxo-4-phenyl-2,8-diazaspiro[4.5]decan-8-yl)-1-oxobutan-2-yl]benzamide
CID 164570122
8-(furan-2-ylmethyl)-2-methyl-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
CID 131662088
4-(4-fluorophenyl)-1-propan-2-ylazepan-4-ol
CID 65077824
(4S)-2-methyl-8-[(5-methylfuran-2-yl)methyl]-4-phenyl-2,8-diazaspiro[4.5]decan-1-one
CID 97415618
(3S,4R)-4-(4-fluorophenyl)-1-propan-2-ylpyrrolidine-3-carboxylic acid;hydrochloride
CID 138628333
1-[1-(4-fluorophenyl)ethyl]-4-propan-2-ylpiperazine
CID 174450752

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one?
The IUPAC name of 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one (CID 67986626) is 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one is CC(C)N1CCC2(CC1)C(=O)N(C)CC2c1ccc(F)cc1.
What is the InChIKey of 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one?
The InChIKey is RWRDOQREEQDGMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25FN2O/c1-13(2)21-10-8-18(9-11-21)16(12-20(3)17(18)22)14-4-6-15(19)7-5-14/h4-7,13,16H,8-12H2,1-3H3.
What are the key properties of 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one?
4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one has a molecular weight of 304.41 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-2-methyl-8-propan-2-yl-2,8-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 67986626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).