4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine

C9H8ClN3S — CID 96603633

IUPAC4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine
SMILESCc1ncsc1-c1cc(Cl)cc(N)n1
InChIInChI=1S/C9H8ClN3S/c1-5-9(14-4-12-5)7-2-6(10)3-8(11)13-7/h2-4H,1H3,(H2,11,13)
InChIKeyJTLAHVNYMYOKQP-UHFFFAOYSA-N
MW225.70 g/mol
LogP2.75
Rot. Bonds1

About 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine

4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine (PubChem CID 96603633) has the molecular formula C9H8ClN3S and a molecular weight of 225.70 g/mol. Its IUPAC name is 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine
PubChem CID96603633
Molecular FormulaC9H8ClN3S
Molecular Weight225.70 g/mol
Exact Mass225.01
IUPAC Name4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine
SMILESCc1ncsc1-c1cc(Cl)cc(N)n1
InChIInChI=1S/C9H8ClN3S/c1-5-9(14-4-12-5)7-2-6(10)3-8(11)13-7/h2-4H,1H3,(H2,11,13)
InChIKeyJTLAHVNYMYOKQP-UHFFFAOYSA-N
XLogP2.75
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.70
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine?
The IUPAC name of 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine (CID 96603633) is 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine?
The canonical SMILES for 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine is Cc1ncsc1-c1cc(Cl)cc(N)n1.
What is the InChIKey of 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine?
The InChIKey is JTLAHVNYMYOKQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3S/c1-5-9(14-4-12-5)7-2-6(10)3-8(11)13-7/h2-4H,1H3,(H2,11,13).
What are the key properties of 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine?
4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine has a molecular weight of 225.70 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(4-methyl-1,3-thiazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 96603633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).