4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide

C8H12N4O2S — CID 114912292

IUPAC4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide
SMILESCC1(C(=O)Nc2cnns2)COCC1N
InChIInChI=1S/C8H12N4O2S/c1-8(4-14-3-5(8)9)7(13)11-6-2-10-12-15-6/h2,5H,3-4,9H2,1H3,(H,11,13)
InChIKeyOIEVTPNDWLOHFZ-UHFFFAOYSA-N
MW228.28 g/mol
LogP-0.16
Rot. Bonds2

About 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide

4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide (PubChem CID 114912292) has the molecular formula C8H12N4O2S and a molecular weight of 228.28 g/mol. Its IUPAC name is 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide
PubChem CID114912292
Molecular FormulaC8H12N4O2S
Molecular Weight228.28 g/mol
Exact Mass228.07
IUPAC Name4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide
SMILESCC1(C(=O)Nc2cnns2)COCC1N
InChIInChI=1S/C8H12N4O2S/c1-8(4-14-3-5(8)9)7(13)11-6-2-10-12-15-6/h2,5H,3-4,9H2,1H3,(H,11,13)
InChIKeyOIEVTPNDWLOHFZ-UHFFFAOYSA-N
XLogP-0.16
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide (CID 114912292) is 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide is CC1(C(=O)Nc2cnns2)COCC1N.
What is the InChIKey of 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
The InChIKey is OIEVTPNDWLOHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2S/c1-8(4-14-3-5(8)9)7(13)11-6-2-10-12-15-6/h2,5H,3-4,9H2,1H3,(H,11,13).
What are the key properties of 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide has a molecular weight of 228.28 g/mol, XLogP of -0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-methyl-N-(thiadiazol-5-yl)oxolane-3-carboxamide is sourced from PubChem (CID 114912292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).