1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one

C16H15NO2 — CID 143669012

IUPAC1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one
SMILESCc1ccc(C2CC(=O)N2c2ccc(O)cc2)cc1
InChIInChI=1S/C16H15NO2/c1-11-2-4-12(5-3-11)15-10-16(19)17(15)13-6-8-14(18)9-7-13/h2-9,15,18H,10H2,1H3
InChIKeyPEKPZAUQIKLOMQ-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.18
Rot. Bonds2

About 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one

1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one (PubChem CID 143669012) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one
PubChem CID143669012
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one
SMILESCc1ccc(C2CC(=O)N2c2ccc(O)cc2)cc1
InChIInChI=1S/C16H15NO2/c1-11-2-4-12(5-3-11)15-10-16(19)17(15)13-6-8-14(18)9-7-13/h2-9,15,18H,10H2,1H3
InChIKeyPEKPZAUQIKLOMQ-UHFFFAOYSA-N
XLogP3.18
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-4-(4-hydroxyphenyl)azetidin-2-one;1-(4-fluorophenyl)propan-1-one
CID 145351703
3-(4-hydroxyphenyl)-2-(4-methylphenyl)-1,3-thiazolidin-4-one
CID 5057465
(4S)-1-(4-fluorophenyl)-4-(4-hydroxyphenyl)azetidin-2-one;(1S)-1-(4-fluorophenyl)propan-1-ol
CID 143251553
4-[2-amino-3-(4-methylphenyl)-4,5-dihydroimidazol-4-yl]phenol
CID 79498766
1-(4-hydroxyphenyl)-4-thiophen-2-ylazetidin-2-one
CID 15496310
(1S)-1-(4-fluorophenyl)propan-1-ol;(4S)-4-(4-hydroxyphenyl)-1-(4-iodophenyl)azetidin-2-one;iodophosphane
CID 143439196
1,4-bis[4-(4-hydroxybutyl)phenyl]azetidin-2-one
CID 143721519
3-acetyl-4-hydroxy-1-(4-hydroxyphenyl)-2-(4-methylphenyl)-2H-pyrrol-5-one
CID 3124166
4-(4-bromophenyl)-1-phenylazetidin-2-one
CID 22142286
3-(4-hydroxyphenyl)cyclopentan-1-one;3-(4-methylphenyl)cyclopentan-1-one
CID 167708371
(4S)-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 10354907
1-(4-fluorophenyl)propan-1-ol;[4-[2-(4-methylphenyl)-4-oxoazetidin-1-yl]phenyl] trifluoromethanesulfonate
CID 143669022

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one?
The IUPAC name of 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one (CID 143669012) is 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one.
What is the SMILES notation for 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one?
The canonical SMILES for 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one is Cc1ccc(C2CC(=O)N2c2ccc(O)cc2)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one?
The InChIKey is PEKPZAUQIKLOMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-11-2-4-12(5-3-11)15-10-16(19)17(15)13-6-8-14(18)9-7-13/h2-9,15,18H,10H2,1H3.
What are the key properties of 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one?
1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one has a molecular weight of 253.30 g/mol, XLogP of 3.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-4-(4-methylphenyl)azetidin-2-one is sourced from PubChem (CID 143669012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).