3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine

C10H9Cl2N3S — CID 60706662

IUPAC3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
SMILESCc1csc(CNc2ncc(Cl)cc2Cl)n1
InChIInChI=1S/C10H9Cl2N3S/c1-6-5-16-9(15-6)4-14-10-8(12)2-7(11)3-13-10/h2-3,5H,4H2,1H3,(H,13,14)
InChIKeyTUKYMJXSSMJRRS-UHFFFAOYSA-N
MW274.18 g/mol
LogP3.77
Rot. Bonds3

About 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine

3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine (PubChem CID 60706662) has the molecular formula C10H9Cl2N3S and a molecular weight of 274.18 g/mol. Its IUPAC name is 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
PubChem CID60706662
Molecular FormulaC10H9Cl2N3S
Molecular Weight274.18 g/mol
Exact Mass272.99
IUPAC Name3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine
SMILESCc1csc(CNc2ncc(Cl)cc2Cl)n1
InChIInChI=1S/C10H9Cl2N3S/c1-6-5-16-9(15-6)4-14-10-8(12)2-7(11)3-13-10/h2-3,5H,4H2,1H3,(H,13,14)
InChIKeyTUKYMJXSSMJRRS-UHFFFAOYSA-N
XLogP3.77
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.18
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine (CID 60706662) is 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine is Cc1csc(CNc2ncc(Cl)cc2Cl)n1.
What is the InChIKey of 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
The InChIKey is TUKYMJXSSMJRRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3S/c1-6-5-16-9(15-6)4-14-10-8(12)2-7(11)3-13-10/h2-3,5H,4H2,1H3,(H,13,14).
What are the key properties of 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine?
3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine has a molecular weight of 274.18 g/mol, XLogP of 3.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 60706662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).