5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole

C16H13ClN2 — CID 10090352

IUPAC5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole
SMILESClc1ccc(C2c3ccccc3C3=NCCN32)cc1
InChIInChI=1S/C16H13ClN2/c17-12-7-5-11(6-8-12)15-13-3-1-2-4-14(13)16-18-9-10-19(15)16/h1-8,15H,9-10H2
InChIKeyZRGPKZSODCXXDH-UHFFFAOYSA-N
MW268.75 g/mol
LogP3.51
Rot. Bonds1

About 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole

5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole (PubChem CID 10090352) has the molecular formula C16H13ClN2 and a molecular weight of 268.75 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole.

Molecular Properties

Compound Name5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole
PubChem CID10090352
Molecular FormulaC16H13ClN2
Molecular Weight268.75 g/mol
Exact Mass268.08
IUPAC Name5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole
SMILESClc1ccc(C2c3ccccc3C3=NCCN32)cc1
InChIInChI=1S/C16H13ClN2/c17-12-7-5-11(6-8-12)15-13-3-1-2-4-14(13)16-18-9-10-19(15)16/h1-8,15H,9-10H2
InChIKeyZRGPKZSODCXXDH-UHFFFAOYSA-N
XLogP3.51
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.75
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(4-chlorophenyl)-6-methyl-3,4-dihydro-2H-pyrimido[2,1-a]isoindole
CID 11000971
5-(2-Chloro-phenyl)-2,3-dihydro-imidazo[2,1-a]isoquinoline
CID 10378954
5-(3-Chloro-phenyl)-2,3-dihydro-imidazo[2,1-a]isoquinoline
CID 10378955
2-[2-(4-Chloro-benzyl)-phenyl]-4,5-dihydro-1H-imidazole
CID 44353722
1-[(Z)-2-(4-Chloro-phenyl)-ethylimino]-3-[(Z)-isopropylimino]-2,3-dihydro-1H-isoindole
CID 136110888
1,3-Bis-[(Z)-2-(4-chloro-phenyl)-ethylimino]-2,3-dihydro-1H-isoindole
CID 136110889
1,3-Bis-[(Z)-2-(4-chloro-phenyl)-propylimino]-2,3-dihydro-1H-isoindole
CID 136110892
5-(2,4-Dichloro-phenyl)-2,3-dihydro-imidazo[2,1-a]isoquinoline
CID 9995815
5-(4-Chloro-phenyl)-2,3-dihydro-imidazo[2,1-a]isoquinoline
CID 10265702
1H-Imidazole, 4,5-dihydro-1-((4-chlorophenyl)methyl)-2-phenyl-, monohydrochloride
CID 3042993
5-[1-(4-Chlorophenyl)cyclopropyl]-2,3-dihydroimidazo[2,1-a]isoquinoline
CID 172450222
5-(4-Chlorophenyl)-5-(p-tolyl)-2,3-dihydroimidazo[2,1-a]isoindole
CID 388690

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole?
The IUPAC name of 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole (CID 10090352) is 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole.
What is the SMILES notation for 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole?
The canonical SMILES for 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole is Clc1ccc(C2c3ccccc3C3=NCCN32)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole?
The InChIKey is ZRGPKZSODCXXDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClN2/c17-12-7-5-11(6-8-12)15-13-3-1-2-4-14(13)16-18-9-10-19(15)16/h1-8,15H,9-10H2.
What are the key properties of 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole?
5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole has a molecular weight of 268.75 g/mol, XLogP of 3.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-3,5-dihydro-2H-imidazo[2,1-a]isoindole is sourced from PubChem (CID 10090352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).