5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine

C6H11N5OS — CID 83024360

IUPAC5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine
SMILESNc1nsc(NN2CCOCC2)n1
InChIInChI=1S/C6H11N5OS/c7-5-8-6(13-10-5)9-11-1-3-12-4-2-11/h1-4H2,(H3,7,8,9,10)
InChIKeyHPKKGZXZWGEYTI-UHFFFAOYSA-N
MW201.25 g/mol
LogP-0.22
Rot. Bonds2

About 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine

5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine (PubChem CID 83024360) has the molecular formula C6H11N5OS and a molecular weight of 201.25 g/mol. Its IUPAC name is 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine.

Molecular Properties

Compound Name5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine
PubChem CID83024360
Molecular FormulaC6H11N5OS
Molecular Weight201.25 g/mol
Exact Mass201.07
IUPAC Name5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine
SMILESNc1nsc(NN2CCOCC2)n1
InChIInChI=1S/C6H11N5OS/c7-5-8-6(13-10-5)9-11-1-3-12-4-2-11/h1-4H2,(H3,7,8,9,10)
InChIKeyHPKKGZXZWGEYTI-UHFFFAOYSA-N
XLogP-0.22
TPSA76.30 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

5-N-piperidin-1-yl-1,2,4-thiadiazole-3,5-diamine
CID 83024267
[4-[(3-amino-1,2,4-thiadiazol-5-yl)amino]oxan-4-yl]methanol
CID 106301087
4-N-morpholin-4-ylpyrimidine-2,4,6-triamine
CID 83027555
6-chloro-2-N-morpholin-4-ylpyridine-2,3-diamine
CID 83003958
2-N-morpholin-4-yl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 83027145
5-bromo-4-N-morpholin-4-ylpyrimidine-2,4-diamine
CID 83027626
6-N-morpholin-4-ylpyridine-2,3,6-triamine
CID 83003580
4-chloro-2-(morpholin-4-ylamino)-1,3-thiazole-5-carbaldehyde
CID 53273580
N-(4,5-diphenyl-1,3-thiazol-2-yl)morpholin-4-amine
CID 10065675
N-(6-chloro-1,3-benzothiazol-2-yl)morpholin-4-amine
CID 83018453
2-N-morpholin-4-ylpyridine-2,5-diamine
CID 83005603
5-N-(dicyclopropylmethyl)-1,2,4-thiadiazole-3,5-diamine
CID 66277907

Frequently Asked Questions

What is the IUPAC name of 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine?
The IUPAC name of 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine (CID 83024360) is 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine.
What is the SMILES notation for 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine?
The canonical SMILES for 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine is Nc1nsc(NN2CCOCC2)n1.
What is the InChIKey of 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine?
The InChIKey is HPKKGZXZWGEYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5OS/c7-5-8-6(13-10-5)9-11-1-3-12-4-2-11/h1-4H2,(H3,7,8,9,10).
What are the key properties of 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine?
5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine has a molecular weight of 201.25 g/mol, XLogP of -0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-morpholin-4-yl-1,2,4-thiadiazole-3,5-diamine is sourced from PubChem (CID 83024360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).