5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine

C12H15N3OS — CID 62475742

IUPAC5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine
SMILESCc1cc(N)cnc1OCCc1scnc1C
InChIInChI=1S/C12H15N3OS/c1-8-5-10(13)6-14-12(8)16-4-3-11-9(2)15-7-17-11/h5-7H,3-4,13H2,1-2H3
InChIKeyCUELYGRPXVPWOI-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.36
Rot. Bonds4

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

5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine (PubChem CID 62475742) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine
PubChem CID62475742
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine
SMILESCc1cc(N)cnc1OCCc1scnc1C
InChIInChI=1S/C12H15N3OS/c1-8-5-10(13)6-14-12(8)16-4-3-11-9(2)15-7-17-11/h5-7H,3-4,13H2,1-2H3
InChIKeyCUELYGRPXVPWOI-UHFFFAOYSA-N
XLogP2.36
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine?
The IUPAC name of 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine (CID 62475742) is 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine.
What is the SMILES notation for 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine?
The canonical SMILES for 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine is Cc1cc(N)cnc1OCCc1scnc1C.
What is the InChIKey of 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine?
The InChIKey is CUELYGRPXVPWOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-8-5-10(13)6-14-12(8)16-4-3-11-9(2)15-7-17-11/h5-7H,3-4,13H2,1-2H3.
What are the key properties of 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine?
5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine has a molecular weight of 249.34 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-6-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]pyridin-3-amine is sourced from PubChem (CID 62475742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).