2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide

C16H16N6O2S — CID 155230575

IUPAC2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(-c2nsc(Nc3ncccc3C(N)=O)n2)nc1
InChIInChI=1S/C16H16N6O2S/c1-9(2)24-10-5-6-12(19-8-10)15-21-16(25-22-15)20-14-11(13(17)23)4-3-7-18-14/h3-9H,1-2H3,(H2,17,23)(H,18,20,21,22)
InChIKeyPLHOPUJWANQJJK-UHFFFAOYSA-N
MW356.41 g/mol
LogP2.62
Rot. Bonds6

About 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide

2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide (PubChem CID 155230575) has the molecular formula C16H16N6O2S and a molecular weight of 356.41 g/mol. Its IUPAC name is 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide
PubChem CID155230575
Molecular FormulaC16H16N6O2S
Molecular Weight356.41 g/mol
Exact Mass356.11
IUPAC Name2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide
SMILESCC(C)Oc1ccc(-c2nsc(Nc3ncccc3C(N)=O)n2)nc1
InChIInChI=1S/C16H16N6O2S/c1-9(2)24-10-5-6-12(19-8-10)15-21-16(25-22-15)20-14-11(13(17)23)4-3-7-18-14/h3-9H,1-2H3,(H2,17,23)(H,18,20,21,22)
InChIKeyPLHOPUJWANQJJK-UHFFFAOYSA-N
XLogP2.62
TPSA115.91 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

CID 44520938
CID 44520938
CID 142609112
CID 142609112
CID 155230143
CID 155230143
CID 155230212
CID 155230212
CID 155230217
CID 155230217
CID 155230223
CID 155230223
CID 155230270
CID 155230270
CID 155230314
CID 155230314
CID 155230363
CID 155230363
CID 155230370
CID 155230370
CID 155230435
CID 155230435
CID 155230437
CID 155230437

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
The IUPAC name of 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide (CID 155230575) is 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide.
What is the SMILES notation for 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
The canonical SMILES for 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide is CC(C)Oc1ccc(-c2nsc(Nc3ncccc3C(N)=O)n2)nc1.
What is the InChIKey of 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
The InChIKey is PLHOPUJWANQJJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N6O2S/c1-9(2)24-10-5-6-12(19-8-10)15-21-16(25-22-15)20-14-11(13(17)23)4-3-7-18-14/h3-9H,1-2H3,(H2,17,23)(H,18,20,21,22).
What are the key properties of 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide?
2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide has a molecular weight of 356.41 g/mol, XLogP of 2.62, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]pyridine-3-carboxamide is sourced from PubChem (CID 155230575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).