3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one

C15H12Cl2N2O — CID 102537060

IUPAC3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
SMILESNC1C(=O)N(c2ccc(Cl)cc2)C1c1ccccc1Cl
InChIInChI=1S/C15H12Cl2N2O/c16-9-5-7-10(8-6-9)19-14(13(18)15(19)20)11-3-1-2-4-12(11)17/h1-8,13-14H,18H2
InChIKeyCCUIYCTZMBUXPJ-UHFFFAOYSA-N
MW307.18 g/mol
LogP3.41
Rot. Bonds2

About 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one

3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one (PubChem CID 102537060) has the molecular formula C15H12Cl2N2O and a molecular weight of 307.18 g/mol. Its IUPAC name is 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one.

Molecular Properties

Compound Name3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
PubChem CID102537060
Molecular FormulaC15H12Cl2N2O
Molecular Weight307.18 g/mol
Exact Mass306.03
IUPAC Name3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
SMILESNC1C(=O)N(c2ccc(Cl)cc2)C1c1ccccc1Cl
InChIInChI=1S/C15H12Cl2N2O/c16-9-5-7-10(8-6-9)19-14(13(18)15(19)20)11-3-1-2-4-12(11)17/h1-8,13-14H,18H2
InChIKeyCCUIYCTZMBUXPJ-UHFFFAOYSA-N
XLogP3.41
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.18
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S,4R)-3-amino-4-(2,4-dichlorophenyl)-1-phenylazetidin-2-one
CID 124503517
(3S,4R)-3-amino-4-(2-chlorophenyl)-1-(3,4-dimethylphenyl)azetidin-2-one
CID 124503983
(3R,4S)-3-amino-4-(2-chlorophenyl)-1-(3-methylphenyl)azetidin-2-one
CID 124503552
3-amino-4-(2-chlorophenyl)-1-(3-fluorophenyl)azetidin-2-one
CID 102536978
(3S,4R)-3-amino-1,4-bis(4-chlorophenyl)azetidin-2-one
CID 124504103
(3R,4S)-3-amino-1-(1,3-benzodioxol-5-yl)-4-(2-chlorophenyl)azetidin-2-one
CID 124503706
(3R,4R)-3-amino-4-(2-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)azetidin-2-one
CID 124503817
(3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
CID 124504101
(3R,4R)-3-amino-4-(2-fluorophenyl)-1-(4-methylphenyl)azetidin-2-one
CID 124503605
(3R,4R)-3-amino-4-(4-bromophenyl)-1-(4-chlorophenyl)azetidin-2-one
CID 124504085
(3R,4R)-3-amino-4-(2,4-dichlorophenyl)-1-(4-ethoxyphenyl)azetidin-2-one
CID 124504230
3-amino-4-(2,4-dichlorophenyl)-1-(3-methoxyphenyl)azetidin-2-one
CID 102537012

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
The IUPAC name of 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one (CID 102537060) is 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one.
What is the SMILES notation for 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
The canonical SMILES for 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one is NC1C(=O)N(c2ccc(Cl)cc2)C1c1ccccc1Cl.
What is the InChIKey of 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
The InChIKey is CCUIYCTZMBUXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N2O/c16-9-5-7-10(8-6-9)19-14(13(18)15(19)20)11-3-1-2-4-12(11)17/h1-8,13-14H,18H2.
What are the key properties of 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one has a molecular weight of 307.18 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one is sourced from PubChem (CID 102537060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).