(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine

C14H11Cl2N — CID 102086135

IUPAC(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine
SMILESClc1ccc(N2C[C@H]2c2ccccc2Cl)cc1
InChIInChI=1S/C14H11Cl2N/c15-10-5-7-11(8-6-10)17-9-14(17)12-3-1-2-4-13(12)16/h1-8,14H,9H2/t14-,17?/m0/s1
InChIKeyFXAKBRRIJDDECI-MBIQTGHCSA-N
MW264.16 g/mol
LogP4.55
Rot. Bonds2

About (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine

(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine (PubChem CID 102086135) has the molecular formula C14H11Cl2N and a molecular weight of 264.16 g/mol. Its IUPAC name is (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine.

Molecular Properties

Compound Name(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine
PubChem CID102086135
Molecular FormulaC14H11Cl2N
Molecular Weight264.16 g/mol
Exact Mass263.03
IUPAC Name(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine
SMILESClc1ccc(N2C[C@H]2c2ccccc2Cl)cc1
InChIInChI=1S/C14H11Cl2N/c15-10-5-7-11(8-6-10)17-9-14(17)12-3-1-2-4-13(12)16/h1-8,14H,9H2/t14-,17?/m0/s1
InChIKeyFXAKBRRIJDDECI-MBIQTGHCSA-N
XLogP4.55
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.16
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

1-(4-chlorophenyl)-5-methyl-2-phenylpiperazine
CID 64937509
(6S)-1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidine-3-carboxylic acid
CID 58956898
1-[(3R,6S)-1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]ethanone
CID 58956949
(2R)-2-(2-chlorophenyl)-1-phenyl-1,4-diazepane
CID 124565905
4-[2-(2-chlorophenyl)aziridin-1-yl]-1,2,4-triazole
CID 57379922
3-(2-chlorophenyl)-1-methylazetidine
CID 167307075
1-(4-chlorophenyl)-2-(2-methylphenyl)piperazine
CID 66735743
3-amino-4-(2-chlorophenyl)-1-(4-chlorophenyl)azetidin-2-one
CID 102537060
1-[1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]-N-methylmethanamine
CID 71176030
4-(4-chlorophenyl)-5-(2,4-dichlorophenyl)-2-propylmorpholine
CID 59435462
1-[1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]-N-naphthalen-1-ylsulfanylmethanamine
CID 143508555
1-[1-(4-chlorophenyl)-6-(2,4-dichlorophenyl)piperidin-3-yl]-N-propylsulfanylmethanamine
CID 143508395

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine?
The IUPAC name of (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine (CID 102086135) is (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine.
What is the SMILES notation for (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine?
The canonical SMILES for (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine is Clc1ccc(N2C[C@H]2c2ccccc2Cl)cc1.
What is the InChIKey of (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine?
The InChIKey is FXAKBRRIJDDECI-MBIQTGHCSA-N. The full InChI is InChI=1S/C14H11Cl2N/c15-10-5-7-11(8-6-10)17-9-14(17)12-3-1-2-4-13(12)16/h1-8,14H,9H2/t14-,17?/m0/s1.
What are the key properties of (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine?
(2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine has a molecular weight of 264.16 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-chlorophenyl)-1-(4-chlorophenyl)aziridine is sourced from PubChem (CID 102086135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).