4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide

C8H12N4O2S — CID 114912231

IUPAC4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)Nc1cnns1
InChIInChI=1S/C8H12N4O2S/c1-9-6-4-14-3-5(6)8(13)11-7-2-10-12-15-7/h2,5-6,9H,3-4H2,1H3,(H,11,13)
InChIKeyRAPZCYFFRPPFKQ-UHFFFAOYSA-N
MW228.28 g/mol
LogP-0.29
Rot. Bonds3

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

4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide (PubChem CID 114912231) has the molecular formula C8H12N4O2S and a molecular weight of 228.28 g/mol. Its IUPAC name is 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide
PubChem CID114912231
Molecular FormulaC8H12N4O2S
Molecular Weight228.28 g/mol
Exact Mass228.07
IUPAC Name4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide
SMILESCNC1COCC1C(=O)Nc1cnns1
InChIInChI=1S/C8H12N4O2S/c1-9-6-4-14-3-5(6)8(13)11-7-2-10-12-15-7/h2,5-6,9H,3-4H2,1H3,(H,11,13)
InChIKeyRAPZCYFFRPPFKQ-UHFFFAOYSA-N
XLogP-0.29
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

CID 113650297
CID 113650297
CID 114912211
CID 114912211
CID 114912233
CID 114912233
CID 114912261
CID 114912261
CID 114912262
CID 114912262
CID 114912292
CID 114912292
CID 128036245
CID 128036245
CID 131002732
CID 131002732

Frequently Asked Questions

What is the IUPAC name of 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
The IUPAC name of 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide (CID 114912231) is 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide is CNC1COCC1C(=O)Nc1cnns1.
What is the InChIKey of 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
The InChIKey is RAPZCYFFRPPFKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2S/c1-9-6-4-14-3-5(6)8(13)11-7-2-10-12-15-7/h2,5-6,9H,3-4H2,1H3,(H,11,13).
What are the key properties of 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide?
4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide has a molecular weight of 228.28 g/mol, XLogP of -0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylamino)-N-(thiadiazol-5-yl)oxolane-3-carboxamide is sourced from PubChem (CID 114912231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).