N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide

C19H22N6O2S — CID 155230370

IUPACN-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide
SMILESCC(=O)N(C)c1cnc(Nc2nc(-c3ccc(OC(C)C)cn3)ns2)c(C)c1
InChIInChI=1S/C19H22N6O2S/c1-11(2)27-15-6-7-16(20-10-15)18-23-19(28-24-18)22-17-12(3)8-14(9-21-17)25(5)13(4)26/h6-11H,1-5H3,(H,21,22,23,24)
InChIKeyITKWGFMMPZILDV-UHFFFAOYSA-N
MW398.49 g/mol
LogP3.82
Rot. Bonds6

About N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide

N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide (PubChem CID 155230370) has the molecular formula C19H22N6O2S and a molecular weight of 398.49 g/mol. Its IUPAC name is N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide
PubChem CID155230370
Molecular FormulaC19H22N6O2S
Molecular Weight398.49 g/mol
Exact Mass398.15
IUPAC NameN-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide
SMILESCC(=O)N(C)c1cnc(Nc2nc(-c3ccc(OC(C)C)cn3)ns2)c(C)c1
InChIInChI=1S/C19H22N6O2S/c1-11(2)27-15-6-7-16(20-10-15)18-23-19(28-24-18)22-17-12(3)8-14(9-21-17)25(5)13(4)26/h6-11H,1-5H3,(H,21,22,23,24)
InChIKeyITKWGFMMPZILDV-UHFFFAOYSA-N
XLogP3.82
TPSA93.13 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.49
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide 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 N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide?
The IUPAC name of N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide (CID 155230370) is N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide.
What is the SMILES notation for N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide?
The canonical SMILES for N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide is CC(=O)N(C)c1cnc(Nc2nc(-c3ccc(OC(C)C)cn3)ns2)c(C)c1.
What is the InChIKey of N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide?
The InChIKey is ITKWGFMMPZILDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2S/c1-11(2)27-15-6-7-16(20-10-15)18-23-19(28-24-18)22-17-12(3)8-14(9-21-17)25(5)13(4)26/h6-11H,1-5H3,(H,21,22,23,24).
What are the key properties of N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide?
N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide has a molecular weight of 398.49 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[5-methyl-6-[[3-(5-propan-2-yloxy-2-pyridinyl)-1,2,4-thiadiazol-5-yl]amino]-3-pyridinyl]acetamide is sourced from PubChem (CID 155230370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).