9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one

C14H21FN2O2 — CID 131685176

IUPAC9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCCN(C(=O)C3(F)CCC3)C2)C1=O
InChIInChI=1S/C14H21FN2O2/c1-16-9-7-13(11(16)18)4-3-8-17(10-13)12(19)14(15)5-2-6-14/h2-10H2,1H3
InChIKeyPFZNDMARXMBRPA-UHFFFAOYSA-N
MW268.33 g/mol
LogP1.35
Rot. Bonds1

About 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one

9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one (PubChem CID 131685176) has the molecular formula C14H21FN2O2 and a molecular weight of 268.33 g/mol. Its IUPAC name is 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one
PubChem CID131685176
Molecular FormulaC14H21FN2O2
Molecular Weight268.33 g/mol
Exact Mass268.16
IUPAC Name9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one
SMILESCN1CCC2(CCCN(C(=O)C3(F)CCC3)C2)C1=O
InChIInChI=1S/C14H21FN2O2/c1-16-9-7-13(11(16)18)4-3-8-17(10-13)12(19)14(15)5-2-6-14/h2-10H2,1H3
InChIKeyPFZNDMARXMBRPA-UHFFFAOYSA-N
XLogP1.35
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.33
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 97125303
1-Methyl-4-(7-methyl-6-azaspiro[3.4]octane-6-carbonyl)piperidin-2-one
CID 128087581
2-(2-Fluoropropyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
CID 66886880
2-(2-Fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decane-1,3-dione
CID 74222349
2-(2-Fluoroethyl)-8-methyl-2,8-diazaspiro[4.5]decan-3-one
CID 123532993
2,9-Ditert-butyl-7,7-difluoro-2,9-diazaspiro[4.5]decan-1-one
CID 171767649
9-Tert-butyl-2-ethyl-7,7-difluoro-2,9-diazaspiro[4.5]decan-1-one
CID 175624381
7-(2-Methoxyethyl)-2-(4,4,4-trifluorobutyl)-2,7-diazaspiro[4.5]decan-6-one
CID 45594816
7-(Cyclobutylmethyl)-2-(4,4,4-trifluorobutyl)-2,7-diazaspiro[4.5]decan-6-one
CID 45597994
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Frequently Asked Questions

What is the IUPAC name of 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
The IUPAC name of 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one (CID 131685176) is 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one is CN1CCC2(CCCN(C(=O)C3(F)CCC3)C2)C1=O.
What is the InChIKey of 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
The InChIKey is PFZNDMARXMBRPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2O2/c1-16-9-7-13(11(16)18)4-3-8-17(10-13)12(19)14(15)5-2-6-14/h2-10H2,1H3.
What are the key properties of 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one?
9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one has a molecular weight of 268.33 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1-fluorocyclobutanecarbonyl)-2-methyl-2,9-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 131685176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).