2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one

C15H17ClN2OS — CID 135989342

IUPAC2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one
SMILESO=C1N/C(=N\c2ccccc2Cl)SC1C1CCCCC1
InChIInChI=1S/C15H17ClN2OS/c16-11-8-4-5-9-12(11)17-15-18-14(19)13(20-15)10-6-2-1-3-7-10/h4-5,8-10,13H,1-3,6-7H2,(H,17,18,19)
InChIKeyCLXNATXQZSWKOJ-UHFFFAOYSA-N
MW308.83 g/mol
LogP4.14
Rot. Bonds2

About 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one

2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one (PubChem CID 135989342) has the molecular formula C15H17ClN2OS and a molecular weight of 308.83 g/mol. Its IUPAC name is 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one
PubChem CID135989342
Molecular FormulaC15H17ClN2OS
Molecular Weight308.83 g/mol
Exact Mass308.08
IUPAC Name2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one
SMILESO=C1N/C(=N\c2ccccc2Cl)SC1C1CCCCC1
InChIInChI=1S/C15H17ClN2OS/c16-11-8-4-5-9-12(11)17-15-18-14(19)13(20-15)10-6-2-1-3-7-10/h4-5,8-10,13H,1-3,6-7H2,(H,17,18,19)
InChIKeyCLXNATXQZSWKOJ-UHFFFAOYSA-N
XLogP4.14
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.83
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-(2-Chlorophenyl)imino-5-cyclopentyl-1,3-thiazolidin-4-one
CID 135989247
5-Cyclohexyl-2-(2-fluorophenyl)imino-1,3-thiazolidin-4-one
CID 135989258
2-(2,6-Dichlorophenyl)imino-5-propan-2-yl-1,3-thiazolidin-4-one
CID 135989325
2-(2,4-Dichlorophenyl)imino-5-propan-2-yl-1,3-thiazolidin-4-one
CID 135989380
2-(2-Chlorophenyl)imino-5-propan-2-yl-1,3-thiazolidin-4-one
CID 135989432
2-(2-Chlorophenyl)imino-5-methyl-1,3-thiazolidin-4-one
CID 135999786
(E)-5-benzyl-2-(phenylimino)thiazolidin-4-one
CID 135406212
Stk347774
CID 135417096
2-(4-Chloroanilino)-5-[(2,3-dichlorophenyl)methyl]-4-thiazolone
CID 135517128
5-(2,3-Dichloro-benzyl)-2-phenylimino-thiazolidin-4-one
CID 135414121
(E)-2-((4-chlorophenyl)imino)-5-(3-(trifluoromethyl)benzyl)thiazolidin-4-one
CID 135414745
5-(4-Chlorobenzyl)-2-((4-chlorophenyl)imino)-1,3-thiazolidin-4-one
CID 135414218

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one?
The IUPAC name of 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one (CID 135989342) is 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one.
What is the SMILES notation for 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one?
The canonical SMILES for 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one is O=C1N/C(=N\c2ccccc2Cl)SC1C1CCCCC1.
What is the InChIKey of 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one?
The InChIKey is CLXNATXQZSWKOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2OS/c16-11-8-4-5-9-12(11)17-15-18-14(19)13(20-15)10-6-2-1-3-7-10/h4-5,8-10,13H,1-3,6-7H2,(H,17,18,19).
What are the key properties of 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one?
2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one has a molecular weight of 308.83 g/mol, XLogP of 4.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)imino-5-cyclohexyl-1,3-thiazolidin-4-one is sourced from PubChem (CID 135989342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).