4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one

C16H21NO2 — CID 10999789

IUPAC4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one
SMILESCOc1ccc(N2C(=O)CC2C2CCCCC2)cc1
InChIInChI=1S/C16H21NO2/c1-19-14-9-7-13(8-10-14)17-15(11-16(17)18)12-5-3-2-4-6-12/h7-10,12,15H,2-6,11H2,1H3
InChIKeyMXKZPPOFJPQZLN-UHFFFAOYSA-N
MW259.35 g/mol
LogP3.38
Rot. Bonds3

About 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one

4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one (PubChem CID 10999789) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one.

Molecular Properties

Compound Name4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one
PubChem CID10999789
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC Name4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one
SMILESCOc1ccc(N2C(=O)CC2C2CCCCC2)cc1
InChIInChI=1S/C16H21NO2/c1-19-14-9-7-13(8-10-14)17-15(11-16(17)18)12-5-3-2-4-6-12/h7-10,12,15H,2-6,11H2,1H3
InChIKeyMXKZPPOFJPQZLN-UHFFFAOYSA-N
XLogP3.38
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4S)-4-cyclohexyl-3-hydroxy-1-(4-methoxyphenyl)azetidin-2-one
CID 11054921
4-(1,4-dioxaspiro[4.5]decan-3-yl)-1-(4-methoxyphenyl)azetidin-2-one
CID 11834088
(4S,5R)-4-bromo-5-hydroxy-1-(4-methoxyphenyl)pyrrolidin-2-one
CID 10891443
(4R)-4-[(1R)-1-hydroxyethyl]-1-(4-methoxyphenyl)azetidin-2-one
CID 71082337
(4S)-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 10354907
1,2-bis(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
CID 3244527
(4R,5R)-1,3,4,5-tetrakis(4-methoxyphenyl)imidazolidin-2-one
CID 11124062
1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
CID 585094
2-(4-methoxyphenyl)-2-azabicyclo[2.2.2]octan-3-one
CID 54072038
N-cycloheptyl-N-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]cyclopropanecarboxamide
CID 23830829
(4aR,7aS)-4-(4-methoxyphenyl)-6,6-dioxo-1,2,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazin-3-one
CID 22690171
4-cyclopentyloxy-1-(4-methoxyphenyl)pyrrolidin-2-one
CID 67672843

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one?
The IUPAC name of 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one (CID 10999789) is 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one.
What is the SMILES notation for 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one?
The canonical SMILES for 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one is COc1ccc(N2C(=O)CC2C2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one?
The InChIKey is MXKZPPOFJPQZLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-19-14-9-7-13(8-10-14)17-15(11-16(17)18)12-5-3-2-4-6-12/h7-10,12,15H,2-6,11H2,1H3.
What are the key properties of 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one?
4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one has a molecular weight of 259.35 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-(4-methoxyphenyl)azetidin-2-one is sourced from PubChem (CID 10999789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).