4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine

C7H4Cl2N2S2 — CID 959110

IUPAC4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2cc(Cl)sc2Cl)cs1
InChIInChI=1S/C7H4Cl2N2S2/c8-5-1-3(6(9)13-5)4-2-12-7(10)11-4/h1-2H,(H2,10,11)
InChIKeyZQLZXFNAKNVLPB-UHFFFAOYSA-N
MW251.16 g/mol
LogP3.76
Rot. Bonds1

About 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine

4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine (PubChem CID 959110) has the molecular formula C7H4Cl2N2S2 and a molecular weight of 251.16 g/mol. Its IUPAC name is 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine
PubChem CID959110
Molecular FormulaC7H4Cl2N2S2
Molecular Weight251.16 g/mol
Exact Mass249.92
IUPAC Name4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine
SMILESNc1nc(-c2cc(Cl)sc2Cl)cs1
InChIInChI=1S/C7H4Cl2N2S2/c8-5-1-3(6(9)13-5)4-2-12-7(10)11-4/h1-2H,(H2,10,11)
InChIKeyZQLZXFNAKNVLPB-UHFFFAOYSA-N
XLogP3.76
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.16
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-methylpropan-1-amine
CID 114082841
4-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]butan-1-amine
CID 114082857
N-[[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]methyl]ethanamine;hydrochloride
CID 120558434
N-[[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]methyl]-2-methylpropan-1-amine
CID 114083008
4-(2,4-dichlorophenyl)-1,3-thiazol-2-amine
CID 704237
5-(2,5-dichlorothiophen-3-yl)-1H-1,2,4-triazol-3-amine
CID 107960252
4-(2,5-dichlorothiophen-3-yl)-2-(3-methoxyphenyl)-1,3-thiazole
CID 18270223
2-chloro-N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]benzamide
CID 4146879
4-(2-chloro-4-fluoro-5-methylphenyl)-1,3-thiazol-2-amine
CID 80717940
N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]pentanamide
CID 4145582
N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-methylsulfanylpropanamide
CID 43077940
N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide
CID 8718070

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine (CID 959110) is 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine is Nc1nc(-c2cc(Cl)sc2Cl)cs1.
What is the InChIKey of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
The InChIKey is ZQLZXFNAKNVLPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Cl2N2S2/c8-5-1-3(6(9)13-5)4-2-12-7(10)11-4/h1-2H,(H2,10,11).
What are the key properties of 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine?
4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine has a molecular weight of 251.16 g/mol, XLogP of 3.76, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 959110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).