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

C15H12Cl2N2O — CID 124504101

IUPAC(3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
SMILESN[C@H]1C(=O)N(c2ccc(Cl)cc2)[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C15H12Cl2N2O/c16-10-4-6-12(7-5-10)19-14(13(18)15(19)20)9-2-1-3-11(17)8-9/h1-8,13-14H,18H2/t13-,14-/m1/s1
InChIKeyWEZSOCJZLLOQNL-ZIAGYGMSSA-N
MW307.18 g/mol
LogP3.41
Rot. Bonds2

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

(3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one (PubChem CID 124504101) has the molecular formula C15H12Cl2N2O and a molecular weight of 307.18 g/mol. Its IUPAC name is (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one.

Molecular Properties

Compound Name(3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
PubChem CID124504101
Molecular FormulaC15H12Cl2N2O
Molecular Weight307.18 g/mol
Exact Mass306.03
IUPAC Name(3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
SMILESN[C@H]1C(=O)N(c2ccc(Cl)cc2)[C@@H]1c1cccc(Cl)c1
InChIInChI=1S/C15H12Cl2N2O/c16-10-4-6-12(7-5-10)19-14(13(18)15(19)20)9-2-1-3-11(17)8-9/h1-8,13-14H,18H2/t13-,14-/m1/s1
InChIKeyWEZSOCJZLLOQNL-ZIAGYGMSSA-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-1,4-bis(4-chlorophenyl)azetidin-2-one
CID 124504103
(3S,4R)-3-amino-4-(3-chlorophenyl)-1-(3-methylphenyl)azetidin-2-one
CID 124503553
3-amino-4-(3-chlorophenyl)-1-(3-methylphenyl)azetidin-2-one
CID 102536929
3-amino-4-(3-chlorophenyl)-1-[3-(trifluoromethyl)phenyl]azetidin-2-one
CID 102536951
(3S,4R)-3-amino-4-(3-chlorophenyl)-1-[3-(trifluoromethyl)phenyl]azetidin-2-one
CID 124503651
(3R,4R)-3-amino-4-(4-bromophenyl)-1-(4-chlorophenyl)azetidin-2-one
CID 124504085
3-amino-4-(4-chlorophenyl)-1-(3-methylphenyl)azetidin-2-one
CID 102536930
(3S,4R)-3-amino-4-(2,4-dichlorophenyl)-1-phenylazetidin-2-one
CID 124503517
3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
CID 102537060
3-amino-1-(4-chlorophenyl)-4-[4-(trifluoromethyl)phenyl]azetidin-2-one
CID 102537065
3-amino-1-(3-chlorophenyl)-4-methylazetidin-2-one
CID 112757920
(3R,4S)-3-amino-1-(3,4-dichlorophenyl)-4-(3-methoxyphenyl)azetidin-2-one
CID 124503922

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
The IUPAC name of (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one (CID 124504101) is (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one.
What is the SMILES notation for (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
The canonical SMILES for (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one is N[C@H]1C(=O)N(c2ccc(Cl)cc2)[C@@H]1c1cccc(Cl)c1.
What is the InChIKey of (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
The InChIKey is WEZSOCJZLLOQNL-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H12Cl2N2O/c16-10-4-6-12(7-5-10)19-14(13(18)15(19)20)9-2-1-3-11(17)8-9/h1-8,13-14H,18H2/t13-,14-/m1/s1.
What are the key properties of (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one?
(3R,4R)-3-amino-4-(3-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 (3R,4R)-3-amino-4-(3-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one is sourced from PubChem (CID 124504101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).