5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine

C19H17N5O2S — CID 88563811

IUPAC5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESCCOc1ncc(-c2ccc3nc(Nc4cccnc4)sc3n2)cc1OC
InChIInChI=1S/C19H17N5O2S/c1-3-26-17-16(25-2)9-12(10-21-17)14-6-7-15-18(23-14)27-19(24-15)22-13-5-4-8-20-11-13/h4-11H,3H2,1-2H3,(H,22,24)
InChIKeyBYOUMLKFSQFDDV-UHFFFAOYSA-N
MW379.45 g/mol
LogP4.30
Rot. Bonds6

About 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine

5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine (PubChem CID 88563811) has the molecular formula C19H17N5O2S and a molecular weight of 379.45 g/mol. Its IUPAC name is 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine.

Molecular Properties

Compound Name5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
PubChem CID88563811
Molecular FormulaC19H17N5O2S
Molecular Weight379.45 g/mol
Exact Mass379.11
IUPAC Name5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESCCOc1ncc(-c2ccc3nc(Nc4cccnc4)sc3n2)cc1OC
InChIInChI=1S/C19H17N5O2S/c1-3-26-17-16(25-2)9-12(10-21-17)14-6-7-15-18(23-14)27-19(24-15)22-13-5-4-8-20-11-13/h4-11H,3H2,1-2H3,(H,22,24)
InChIKeyBYOUMLKFSQFDDV-UHFFFAOYSA-N
XLogP4.30
TPSA82.05 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.45
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The IUPAC name of 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine (CID 88563811) is 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine.
What is the SMILES notation for 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The canonical SMILES for 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine is CCOc1ncc(-c2ccc3nc(Nc4cccnc4)sc3n2)cc1OC.
What is the InChIKey of 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The InChIKey is BYOUMLKFSQFDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O2S/c1-3-26-17-16(25-2)9-12(10-21-17)14-6-7-15-18(23-14)27-19(24-15)22-13-5-4-8-20-11-13/h4-11H,3H2,1-2H3,(H,22,24).
What are the key properties of 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine has a molecular weight of 379.45 g/mol, XLogP of 4.30, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-ethoxy-5-methoxy-3-pyridinyl)-N-pyridin-3-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine is sourced from PubChem (CID 88563811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).