4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine

C14H10ClN3S — CID 2740205

IUPAC4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine
SMILESClc1cccc(-c2csc(Nc3cccnc3)n2)c1
InChIInChI=1S/C14H10ClN3S/c15-11-4-1-3-10(7-11)13-9-19-14(18-13)17-12-5-2-6-16-8-12/h1-9H,(H,17,18)
InChIKeyTYDLBYKMMQYLSJ-UHFFFAOYSA-N
MW287.78 g/mol
LogP4.60
Rot. Bonds3

About 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine

4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine (PubChem CID 2740205) has the molecular formula C14H10ClN3S and a molecular weight of 287.78 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine
PubChem CID2740205
Molecular FormulaC14H10ClN3S
Molecular Weight287.78 g/mol
Exact Mass287.03
IUPAC Name4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine
SMILESClc1cccc(-c2csc(Nc3cccnc3)n2)c1
InChIInChI=1S/C14H10ClN3S/c15-11-4-1-3-10(7-11)13-9-19-14(18-13)17-12-5-2-6-16-8-12/h1-9H,(H,17,18)
InChIKeyTYDLBYKMMQYLSJ-UHFFFAOYSA-N
XLogP4.60
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.78
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Stf-62247
CID 704473
N-(5-chloropyridin-2-yl)-4-pyridin-2-yl-1,3-thiazol-2-amine
CID 973099
(4-Phenyl-thiazol-2-yl)-pyridin-2-yl-amine
CID 750531
N-(2-ethylphenyl)-4-(pyridin-3-yl)-1,3-thiazol-2-amine
CID 746667
(3-Methyl-pyridin-2-yl)-(4-pyridin-2-yl-thiazol-2-yl)-amine
CID 972880
Aminothiazole 7
CID 5329389
Aminothiazole 8
CID 5329390
N-(6-methylpyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329394
N-(5-chloropyridin-2-yl)-5-phenyl-1,3-thiazol-2-amine
CID 5329395
4-(3-Chlorophenyl)-5-(1,5-naphthyridin-2-yl)-1,3-thiazol-2-amine
CID 11473228
N-[5-(5-benzenesulphonamido-6-chloropyridin-3-yl)-4-methylthiazol-2-yl]acetamide
CID 11541283
N1-(4-(2-chlorophenyl)-6-(2-(isopropylamino)thiazol-5-yl)pyrimidin-2-yl)-N2,N2-dimethylethane-1,2-diamine
CID 52949671

Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
The IUPAC name of 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine (CID 2740205) is 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine is Clc1cccc(-c2csc(Nc3cccnc3)n2)c1.
What is the InChIKey of 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
The InChIKey is TYDLBYKMMQYLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3S/c15-11-4-1-3-10(7-11)13-9-19-14(18-13)17-12-5-2-6-16-8-12/h1-9H,(H,17,18).
What are the key properties of 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine?
4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine has a molecular weight of 287.78 g/mol, XLogP of 4.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-N-pyridin-3-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 2740205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).