5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine

C11H10Cl2N2S — CID 116812059

IUPAC5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2cc(Cl)cc(Cl)c2)s1
InChIInChI=1S/C11H10Cl2N2S/c1-2-14-11-15-6-10(16-11)7-3-8(12)5-9(13)4-7/h3-6H,2H2,1H3,(H,14,15)
InChIKeyHBKQHXVHSZVZQV-UHFFFAOYSA-N
MW273.19 g/mol
LogP4.55
Rot. Bonds3

About 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine

5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine (PubChem CID 116812059) has the molecular formula C11H10Cl2N2S and a molecular weight of 273.19 g/mol. Its IUPAC name is 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine
PubChem CID116812059
Molecular FormulaC11H10Cl2N2S
Molecular Weight273.19 g/mol
Exact Mass271.99
IUPAC Name5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine
SMILESCCNc1ncc(-c2cc(Cl)cc(Cl)c2)s1
InChIInChI=1S/C11H10Cl2N2S/c1-2-14-11-15-6-10(16-11)7-3-8(12)5-9(13)4-7/h3-6H,2H2,1H3,(H,14,15)
InChIKeyHBKQHXVHSZVZQV-UHFFFAOYSA-N
XLogP4.55
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.19
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-chlorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116811958
N-ethyl-5-(4-methoxyphenyl)-1,3-thiazol-2-amine
CID 116811972
5-(3-chlorophenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 116812281
5-(2,5-dimethylphenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812054
N-ethyl-5-(7-methoxy-1,3-benzodioxol-5-yl)-1,3-thiazol-2-amine
CID 116812081
5-(2,4-difluorophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116811974
N-(3,5-dichlorophenyl)-5-phenyl-1,3-thiazol-2-amine
CID 11652687
5-(2-bromophenyl)-N-ethyl-1,3-thiazol-2-amine
CID 116812031
5-(5-chloroquinolin-8-yl)-N-ethyl-1,3-thiazol-2-amine
CID 116811986
N-ethyl-5-(2-ethylpyrazol-3-yl)-1,3-thiazol-2-amine
CID 114558342
5-(3-chloro-4-fluorophenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
CID 116812431
2-(3,5-dichlorophenyl)-N-ethylpyrimidin-4-amine
CID 62201542

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine (CID 116812059) is 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine is CCNc1ncc(-c2cc(Cl)cc(Cl)c2)s1.
What is the InChIKey of 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine?
The InChIKey is HBKQHXVHSZVZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2S/c1-2-14-11-15-6-10(16-11)7-3-8(12)5-9(13)4-7/h3-6H,2H2,1H3,(H,14,15).
What are the key properties of 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine?
5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine has a molecular weight of 273.19 g/mol, XLogP of 4.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dichlorophenyl)-N-ethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 116812059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).