3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide

C7H14N2O4S — CID 130571757

IUPAC3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide
SMILESCNC1(C(=O)NS(C)(=O)=O)CCOC1
InChIInChI=1S/C7H14N2O4S/c1-8-7(3-4-13-5-7)6(10)9-14(2,11)12/h8H,3-5H2,1-2H3,(H,9,10)
InChIKeyYQSNTUYAKAIFMO-UHFFFAOYSA-N
MW222.27 g/mol
LogP-1.56
Rot. Bonds3

About 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide

3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide (PubChem CID 130571757) has the molecular formula C7H14N2O4S and a molecular weight of 222.27 g/mol. Its IUPAC name is 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide.

Molecular Properties

Compound Name3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide
PubChem CID130571757
Molecular FormulaC7H14N2O4S
Molecular Weight222.27 g/mol
Exact Mass222.07
IUPAC Name3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide
SMILESCNC1(C(=O)NS(C)(=O)=O)CCOC1
InChIInChI=1S/C7H14N2O4S/c1-8-7(3-4-13-5-7)6(10)9-14(2,11)12/h8H,3-5H2,1-2H3,(H,9,10)
InChIKeyYQSNTUYAKAIFMO-UHFFFAOYSA-N
XLogP-1.56
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.27
LogP ≤ 5-1.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-3-(methylamino)oxolane-3-carboxylic acid
CID 95380076
3-(methylamino)-N-(2-methylcyclopropyl)oxolane-3-carboxamide
CID 126982804
3-(propan-2-ylsulfonylamino)oxolane-3-carboxylic acid
CID 64888098
3-(ethylamino)oxolane-3-carboxylic acid
CID 63335789
3-(methylphosphanylamino)oxolane-3-carboxylic acid
CID 89260571
3-[[methyl(2-methylsulfonylethyl)carbamoyl]amino]oxolane-3-carboxylic acid
CID 79864967
N-methylsulfonyl-1-[12-[1-(methylsulfonylcarbamoyl)cyclopropyl]dodecyl]cyclopropane-1-carboxamide
CID 74220560
N,3-dimethyloxolane-3-carboxamide
CID 127840773
3-[(3-methylsulfonylbenzoyl)amino]oxolane-3-carboxylic acid
CID 64888224
3-(butanoylamino)oxolane-3-carboxylic acid
CID 64889566
4-(aminomethyl)-N-methylsulfonylbicyclo[2.2.2]octane-1-carboxamide;hydrochloride
CID 158402337
3-[3-(methylamino)propylcarbamoylamino]oxolane-3-carboxylic acid
CID 64893261

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide?
The IUPAC name of 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide (CID 130571757) is 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide.
What is the SMILES notation for 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide?
The canonical SMILES for 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide is CNC1(C(=O)NS(C)(=O)=O)CCOC1.
What is the InChIKey of 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide?
The InChIKey is YQSNTUYAKAIFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O4S/c1-8-7(3-4-13-5-7)6(10)9-14(2,11)12/h8H,3-5H2,1-2H3,(H,9,10).
What are the key properties of 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide?
3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide has a molecular weight of 222.27 g/mol, XLogP of -1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-N-methylsulfonyloxolane-3-carboxamide is sourced from PubChem (CID 130571757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).