2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide

C6H10N4O2S — CID 130626992

IUPAC2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide
SMILESCNC(=O)C(O)CNc1ncns1
InChIInChI=1S/C6H10N4O2S/c1-7-5(12)4(11)2-8-6-9-3-10-13-6/h3-4,11H,2H2,1H3,(H,7,12)(H,8,9,10)
InChIKeyLFMWBUPZDOOWQH-UHFFFAOYSA-N
MW202.24 g/mol
LogP-0.94
Rot. Bonds4

About 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide

2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide (PubChem CID 130626992) has the molecular formula C6H10N4O2S and a molecular weight of 202.24 g/mol. Its IUPAC name is 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide.

Molecular Properties

Compound Name2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide
PubChem CID130626992
Molecular FormulaC6H10N4O2S
Molecular Weight202.24 g/mol
Exact Mass202.05
IUPAC Name2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide
SMILESCNC(=O)C(O)CNc1ncns1
InChIInChI=1S/C6H10N4O2S/c1-7-5(12)4(11)2-8-6-9-3-10-13-6/h3-4,11H,2H2,1H3,(H,7,12)(H,8,9,10)
InChIKeyLFMWBUPZDOOWQH-UHFFFAOYSA-N
XLogP-0.94
TPSA87.14 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.24
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide?
The IUPAC name of 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide (CID 130626992) is 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide.
What is the SMILES notation for 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide?
The canonical SMILES for 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide is CNC(=O)C(O)CNc1ncns1.
What is the InChIKey of 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide?
The InChIKey is LFMWBUPZDOOWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2S/c1-7-5(12)4(11)2-8-6-9-3-10-13-6/h3-4,11H,2H2,1H3,(H,7,12)(H,8,9,10).
What are the key properties of 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide?
2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide has a molecular weight of 202.24 g/mol, XLogP of -0.94, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-methyl-3-(1,2,4-thiadiazol-5-ylamino)propanamide is sourced from PubChem (CID 130626992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).