2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide

C10H20N2O4S — CID 114232726

IUPAC2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CS(=O)(=O)C1COCCC1N
InChIInChI=1S/C10H20N2O4S/c1-7(2)12-10(13)6-17(14,15)9-5-16-4-3-8(9)11/h7-9H,3-6,11H2,1-2H3,(H,12,13)
InChIKeyFBGYPCJLEXIJTG-UHFFFAOYSA-N
MW264.35 g/mol
LogP-0.96
Rot. Bonds4

About 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide

2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide (PubChem CID 114232726) has the molecular formula C10H20N2O4S and a molecular weight of 264.35 g/mol. Its IUPAC name is 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide
PubChem CID114232726
Molecular FormulaC10H20N2O4S
Molecular Weight264.35 g/mol
Exact Mass264.11
IUPAC Name2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CS(=O)(=O)C1COCCC1N
InChIInChI=1S/C10H20N2O4S/c1-7(2)12-10(13)6-17(14,15)9-5-16-4-3-8(9)11/h7-9H,3-6,11H2,1-2H3,(H,12,13)
InChIKeyFBGYPCJLEXIJTG-UHFFFAOYSA-N
XLogP-0.96
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 5-0.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-2-[4-(methylamino)oxan-3-yl]sulfonylacetamide
CID 114232783
3-[2-(oxolan-3-yl)ethylamino]-N-propan-2-ylpropanamide
CID 102671535
2-[1-(oxolan-3-yl)ethylamino]-N-propan-2-ylacetamide
CID 115707603
N-[2-oxo-2-(propan-2-ylamino)ethyl]oxane-4-carboxamide
CID 51220547
2-(4-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777737
(2R)-2-[(2-cyclopentylsulfonylacetyl)amino]-3-methylbutanoic acid
CID 119369506
3-(2-methyloxolan-3-yl)sulfonyloxan-4-amine
CID 107758120
2-amino-N-[1-(oxolan-3-yl)ethyl]acetamide
CID 115734721
2-[ethyl-[2-oxo-2-(oxolan-3-yl)ethyl]amino]-N-propan-2-ylacetamide
CID 113448780
(3R)-N-propan-2-yloxolane-3-sulfonamide
CID 97175132
2-(2-aminopropylsulfonyl)-N-propan-2-ylacetamide
CID 81189323
2-(3-aminocyclohexyl)-N-propan-2-ylacetamide
CID 62777908

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide (CID 114232726) is 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide is CC(C)NC(=O)CS(=O)(=O)C1COCCC1N.
What is the InChIKey of 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide?
The InChIKey is FBGYPCJLEXIJTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4S/c1-7(2)12-10(13)6-17(14,15)9-5-16-4-3-8(9)11/h7-9H,3-6,11H2,1-2H3,(H,12,13).
What are the key properties of 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide?
2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide has a molecular weight of 264.35 g/mol, XLogP of -0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminooxan-3-yl)sulfonyl-N-propan-2-ylacetamide is sourced from PubChem (CID 114232726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).