N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide

C12H15N5O2S — CID 91948937

IUPACN-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnc2nsnc2c1
InChIInChI=1S/C12H15N5O2S/c18-12(13-1-2-17-3-5-19-6-4-17)9-7-10-11(14-8-9)16-20-15-10/h7-8H,1-6H2,(H,13,18)
InChIKeyHDALFKRHRIAMCF-UHFFFAOYSA-N
MW293.35 g/mol
LogP0.15
Rot. Bonds4

About N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide

N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide (PubChem CID 91948937) has the molecular formula C12H15N5O2S and a molecular weight of 293.35 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide
PubChem CID91948937
Molecular FormulaC12H15N5O2S
Molecular Weight293.35 g/mol
Exact Mass293.09
IUPAC NameN-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cnc2nsnc2c1
InChIInChI=1S/C12H15N5O2S/c18-12(13-1-2-17-3-5-19-6-4-17)9-7-10-11(14-8-9)16-20-15-10/h7-8H,1-6H2,(H,13,18)
InChIKeyHDALFKRHRIAMCF-UHFFFAOYSA-N
XLogP0.15
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-cyclopropyl-N-(2-morpholin-4-ylethyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 175644669
6-methoxy-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 47126571
5-N-cyclopentyl-3-N-(2-morpholin-4-ylethyl)pyridine-3,5-dicarboxamide
CID 109102673
2-amino-N-(2-morpholin-4-ylethyl)quinazoline-7-carboxamide
CID 143569714
5-chloro-6-(ethylamino)-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 62166235
2-(cyclopentylamino)-N-(2-morpholin-4-ylethyl)pyrimidine-5-carboxamide
CID 109249721
2-methoxy-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 84580344
2-(4-formylpiperazin-1-yl)-N-(2-morpholin-4-ylethyl)pyrimidine-5-carboxamide
CID 109253039
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309
1-cyclohexyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide
CID 3243473
6-[3-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyridine-3-carboxylic acid
CID 121495695
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide (CID 91948937) is N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide is O=C(NCCN1CCOCC1)c1cnc2nsnc2c1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide?
The InChIKey is HDALFKRHRIAMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2S/c18-12(13-1-2-17-3-5-19-6-4-17)9-7-10-11(14-8-9)16-20-15-10/h7-8H,1-6H2,(H,13,18).
What are the key properties of N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide?
N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide has a molecular weight of 293.35 g/mol, XLogP of 0.15, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-[1,2,5]thiadiazolo[3,4-b]pyridine-6-carboxamide is sourced from PubChem (CID 91948937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).