N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide

C19H14N4O2S — CID 155528179

IUPACN-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ncccc2-c2nc3ccncc3s2)cc1
InChIInChI=1S/C19H14N4O2S/c1-12(24)22-13-4-6-14(7-5-13)25-18-15(3-2-9-21-18)19-23-16-8-10-20-11-17(16)26-19/h2-11H,1H3,(H,22,24)
InChIKeyRCNCAGCWVSPJGG-UHFFFAOYSA-N
MW362.41 g/mol
LogP4.50
Rot. Bonds4

About N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide

N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide (PubChem CID 155528179) has the molecular formula C19H14N4O2S and a molecular weight of 362.41 g/mol. Its IUPAC name is N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide
PubChem CID155528179
Molecular FormulaC19H14N4O2S
Molecular Weight362.41 g/mol
Exact Mass362.08
IUPAC NameN-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ncccc2-c2nc3ccncc3s2)cc1
InChIInChI=1S/C19H14N4O2S/c1-12(24)22-13-4-6-14(7-5-13)25-18-15(3-2-9-21-18)19-23-16-8-10-20-11-17(16)26-19/h2-11H,1H3,(H,22,24)
InChIKeyRCNCAGCWVSPJGG-UHFFFAOYSA-N
XLogP4.50
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide?
The IUPAC name of N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide (CID 155528179) is N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide?
The canonical SMILES for N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide is CC(=O)Nc1ccc(Oc2ncccc2-c2nc3ccncc3s2)cc1.
What is the InChIKey of N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide?
The InChIKey is RCNCAGCWVSPJGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2S/c1-12(24)22-13-4-6-14(7-5-13)25-18-15(3-2-9-21-18)19-23-16-8-10-20-11-17(16)26-19/h2-11H,1H3,(H,22,24).
What are the key properties of N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide?
N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide has a molecular weight of 362.41 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[3-([1,3]thiazolo[5,4-c]pyridin-2-yl)-2-pyridinyl]oxy]phenyl]acetamide is sourced from PubChem (CID 155528179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).