(4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one

C11H17NO2 — CID 10932352

IUPAC(4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one
SMILESO=C1C[C@@H]([C@@H]2CCCCCCC2=O)N1
InChIInChI=1S/C11H17NO2/c13-10-6-4-2-1-3-5-8(10)9-7-11(14)12-9/h8-9H,1-7H2,(H,12,14)/t8-,9-/m0/s1
InChIKeyBBMWPLXWQGPGSH-IUCAKERBSA-N
MW195.26 g/mol
LogP1.41
Rot. Bonds1

About (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one

(4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one (PubChem CID 10932352) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one.

Molecular Properties

Compound Name(4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one
PubChem CID10932352
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name(4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one
SMILESO=C1C[C@@H]([C@@H]2CCCCCCC2=O)N1
InChIInChI=1S/C11H17NO2/c13-10-6-4-2-1-3-5-8(10)9-7-11(14)12-9/h8-9H,1-7H2,(H,12,14)/t8-,9-/m0/s1
InChIKeyBBMWPLXWQGPGSH-IUCAKERBSA-N
XLogP1.41
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-4-[(1R)-2-oxocyclopentyl]azetidin-2-one
CID 93233730
(4R)-4-[(1S)-2-oxocyclopentyl]azetidin-2-one
CID 93233733
(3aR,8aR)-2,3,3a,5,6,7,8,8a-octahydroazulene-1,4-dione
CID 12696314
(3aR,10aS)-2,3,3a,5,6,7,8,9,10,10a-decahydro-1H-cyclopenta[9]annulen-4-one
CID 102063189
2-(5-methylmorpholin-3-yl)cycloheptan-1-one
CID 116685230
(4aR,8aS)-2,3,4a,5,6,7,8,8a-octahydronaphthalene-1,4-dione
CID 13235573
(4aR,8aR)-2,3,4a,5,6,7,8,8a-octahydronaphthalene-1,4-dione
CID 13235574
(2S)-2-[(3S)-morpholin-3-yl]cyclohexan-1-one
CID 96581630
(8S)-bicyclo[6.1.0]nonan-2-one
CID 90487048
bicyclo[13.1.0]hexadecan-2-one
CID 543951
(2R)-2-[(2S)-pyrrolidin-2-yl]cyclopentan-1-one
CID 97048991
(4aR,8aS)-2,3,4,4a,6,7,8,8a-octahydro-1H-quinolin-5-one
CID 70494313

Frequently Asked Questions

What is the IUPAC name of (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one?
The IUPAC name of (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one (CID 10932352) is (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one.
What is the SMILES notation for (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one?
The canonical SMILES for (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one is O=C1C[C@@H]([C@@H]2CCCCCCC2=O)N1.
What is the InChIKey of (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one?
The InChIKey is BBMWPLXWQGPGSH-IUCAKERBSA-N. The full InChI is InChI=1S/C11H17NO2/c13-10-6-4-2-1-3-5-8(10)9-7-11(14)12-9/h8-9H,1-7H2,(H,12,14)/t8-,9-/m0/s1.
What are the key properties of (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one?
(4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one has a molecular weight of 195.26 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-[(1S)-2-oxocyclooctyl]azetidin-2-one is sourced from PubChem (CID 10932352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).