2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide

C6H11N5O2S — CID 106241467

IUPAC2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide
SMILESNC(=O)COCCNc1nc(N)ns1
InChIInChI=1S/C6H11N5O2S/c7-4(12)3-13-2-1-9-6-10-5(8)11-14-6/h1-3H2,(H2,7,12)(H3,8,9,10,11)
InChIKeyMIWWACLZSHAHJT-UHFFFAOYSA-N
MW217.25 g/mol
LogP-0.97
Rot. Bonds6

About 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide

2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide (PubChem CID 106241467) has the molecular formula C6H11N5O2S and a molecular weight of 217.25 g/mol. Its IUPAC name is 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide.

Molecular Properties

Compound Name2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide
PubChem CID106241467
Molecular FormulaC6H11N5O2S
Molecular Weight217.25 g/mol
Exact Mass217.06
IUPAC Name2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide
SMILESNC(=O)COCCNc1nc(N)ns1
InChIInChI=1S/C6H11N5O2S/c7-4(12)3-13-2-1-9-6-10-5(8)11-14-6/h1-3H2,(H2,7,12)(H3,8,9,10,11)
InChIKeyMIWWACLZSHAHJT-UHFFFAOYSA-N
XLogP-0.97
TPSA116.15 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.25
LogP ≤ 5-0.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-[(3-propyl-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide
CID 106239169
5-N-(3-propoxypropyl)-1,2,4-thiadiazole-3,5-diamine
CID 82947352
2-[2-[(3-amino-4-methoxy-1,2-thiazol-5-yl)amino]ethoxy]acetamide
CID 106242128
methyl 2-[2-(2-amino-2-oxoethoxy)ethylamino]-5-methyl-1,3-thiazole-4-carboxylate
CID 106241502
2-[2-[(3-amino-4-methylsulfanyl-1,2-thiazol-5-yl)amino]ethoxy]acetamide
CID 106242108
2-[2-[(4-chloro-1,2,5-thiadiazol-3-yl)amino]ethoxy]acetamide
CID 106240109
5-N-(2-cyclohexyloxyethyl)-1,2,4-thiadiazole-3,5-diamine
CID 66278347
2-[2-[(5,6-diamino-2-pyridinyl)amino]ethoxy]acetamide
CID 106234451
2-[2-[(5-methyl-1,3-benzothiazol-2-yl)amino]ethoxy]acetamide
CID 106240152
methyl 2-[2-(2-amino-2-oxoethoxy)ethylamino]-1,3-thiazole-5-carboxylate
CID 106241505
2-[2-[(3-amino-6-methyl-2-pyridinyl)amino]ethoxy]acetamide
CID 106234320
3-[(3-amino-1,2,4-thiadiazol-5-yl)amino]propane-1-sulfonamide
CID 66280540

Frequently Asked Questions

What is the IUPAC name of 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide?
The IUPAC name of 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide (CID 106241467) is 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide.
What is the SMILES notation for 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide?
The canonical SMILES for 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide is NC(=O)COCCNc1nc(N)ns1.
What is the InChIKey of 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide?
The InChIKey is MIWWACLZSHAHJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5O2S/c7-4(12)3-13-2-1-9-6-10-5(8)11-14-6/h1-3H2,(H2,7,12)(H3,8,9,10,11).
What are the key properties of 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide?
2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide has a molecular weight of 217.25 g/mol, XLogP of -0.97, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(3-amino-1,2,4-thiadiazol-5-yl)amino]ethoxy]acetamide is sourced from PubChem (CID 106241467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).