7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one

C15H19FN2O — CID 56900937

IUPAC7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESO=C1N(Cc2ccc(F)cc2)CCCC12CCNC2
InChIInChI=1S/C15H19FN2O/c16-13-4-2-12(3-5-13)10-18-9-1-6-15(14(18)19)7-8-17-11-15/h2-5,17H,1,6-11H2
InChIKeyBEAFJVANWSQDDL-UHFFFAOYSA-N
MW262.33 g/mol
LogP1.93
Rot. Bonds2

About 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one

7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one (PubChem CID 56900937) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one.

Molecular Properties

Compound Name7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
PubChem CID56900937
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
SMILESO=C1N(Cc2ccc(F)cc2)CCCC12CCNC2
InChIInChI=1S/C15H19FN2O/c16-13-4-2-12(3-5-13)10-18-9-1-6-15(14(18)19)7-8-17-11-15/h2-5,17H,1,6-11H2
InChIKeyBEAFJVANWSQDDL-UHFFFAOYSA-N
XLogP1.93
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-[(4-propan-2-ylphenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 56887747
2-[(3-fluorophenyl)methyl]-2,7-diazaspiro[4.4]nonan-1-one;hydrochloride
CID 155852318
(5S)-7-(2-phenylethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 95711606
2-[(2-fluorophenyl)methyl]-2,8-diazaspiro[5.5]undecan-1-one;hydrochloride
CID 45074394
2-[(4-nitrophenyl)methyl]-2,9-diazaspiro[4.5]decan-1-one;hydrochloride
CID 45074137
2-[(2-iodophenyl)methyl]-2,8-diazaspiro[5.5]undecan-1-one
CID 45074407
2-[(3-bromophenyl)methyl]-2,9-diazaspiro[5.5]undecan-1-one
CID 45074340
(5S)-7-[(4-fluorophenyl)methyl]-2-(6-oxo-1H-pyridine-3-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 95721661
2-[(3-nitrophenyl)methyl]-2,8-diazaspiro[5.5]undecan-1-one;hydrochloride
CID 45074374
(5S)-7-[(4-fluorophenyl)methyl]-2-(1H-imidazole-5-carbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 42529834
1-[7-[(4-fluorophenyl)methyl]-6-oxo-2,7-diazaspiro[4.5]decan-2-yl]-2-phenylethane-1,2-dione
CID 45251564
2-[2-(diethylamino)acetyl]-7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one
CID 56905387

Frequently Asked Questions

What is the IUPAC name of 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
The IUPAC name of 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one (CID 56900937) is 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one.
What is the SMILES notation for 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
The canonical SMILES for 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one is O=C1N(Cc2ccc(F)cc2)CCCC12CCNC2.
What is the InChIKey of 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
The InChIKey is BEAFJVANWSQDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c16-13-4-2-12(3-5-13)10-18-9-1-6-15(14(18)19)7-8-17-11-15/h2-5,17H,1,6-11H2.
What are the key properties of 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one?
7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one has a molecular weight of 262.33 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)methyl]-2,7-diazaspiro[4.5]decan-6-one is sourced from PubChem (CID 56900937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).