5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine

C14H10ClN3S — CID 18506841

IUPAC5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
SMILESClc1ccccc1-c1cnc(Nc2ccccn2)s1
InChIInChI=1S/C14H10ClN3S/c15-11-6-2-1-5-10(11)12-9-17-14(19-12)18-13-7-3-4-8-16-13/h1-9H,(H,16,17,18)
InChIKeySRQFSLDCOLMLLX-UHFFFAOYSA-N
MW287.78 g/mol
LogP4.60
Rot. Bonds3

About 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine

5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine (PubChem CID 18506841) has the molecular formula C14H10ClN3S and a molecular weight of 287.78 g/mol. Its IUPAC name is 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
PubChem CID18506841
Molecular FormulaC14H10ClN3S
Molecular Weight287.78 g/mol
Exact Mass287.03
IUPAC Name5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine
SMILESClc1ccccc1-c1cnc(Nc2ccccn2)s1
InChIInChI=1S/C14H10ClN3S/c15-11-6-2-1-5-10(11)12-9-17-14(19-12)18-13-7-3-4-8-16-13/h1-9H,(H,16,17,18)
InChIKeySRQFSLDCOLMLLX-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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Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
The IUPAC name of 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine (CID 18506841) is 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine is Clc1ccccc1-c1cnc(Nc2ccccn2)s1.
What is the InChIKey of 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
The InChIKey is SRQFSLDCOLMLLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3S/c15-11-6-2-1-5-10(11)12-9-17-14(19-12)18-13-7-3-4-8-16-13/h1-9H,(H,16,17,18).
What are the key properties of 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine?
5-(2-chlorophenyl)-N-pyridin-2-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 5-(2-chlorophenyl)-N-pyridin-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 18506841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).