2-methyl-4-(sulfamoylamino)oxane

C6H14N2O3S — CID 103887477

IUPAC2-methyl-4-(sulfamoylamino)oxane
SMILESCC1CC(NS(N)(=O)=O)CCO1
InChIInChI=1S/C6H14N2O3S/c1-5-4-6(2-3-11-5)8-12(7,9)10/h5-6,8H,2-4H2,1H3,(H2,7,9,10)
InChIKeyZSTYEDPTCOOFHR-UHFFFAOYSA-N
MW194.26 g/mol
LogP-0.65
Rot. Bonds2

About 2-methyl-4-(sulfamoylamino)oxane

2-methyl-4-(sulfamoylamino)oxane (PubChem CID 103887477) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-methyl-4-(sulfamoylamino)oxane.

Molecular Properties

Compound Name2-methyl-4-(sulfamoylamino)oxane
PubChem CID103887477
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name2-methyl-4-(sulfamoylamino)oxane
SMILESCC1CC(NS(N)(=O)=O)CCO1
InChIInChI=1S/C6H14N2O3S/c1-5-4-6(2-3-11-5)8-12(7,9)10/h5-6,8H,2-4H2,1H3,(H2,7,9,10)
InChIKeyZSTYEDPTCOOFHR-UHFFFAOYSA-N
XLogP-0.65
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Methyloxan-4-amine
CID 23123995
N-(oxan-4-yl)aminosulfonamide
CID 112686109
4-Propyl-1,2,3-oxathiazinane 2,2-dioxide
CID 91844916
(2S,4S)-2-Methyl-tetrahydro-pyran-4-ylamine
CID 68074002
2-[(Sulfamoylamino)methyl]oxane
CID 69182198
rel-(2R,4R)-2-Methyltetrahydro-2H-pyran-4-amine
CID 82650947
(2R,4S)-2-Methyl-tetrahydro-pyran-4-ylamine
CID 82650948
(4S)-2-methyloxan-4-amine
CID 118528143
CID 146697397
CID 146697397
(2R)-2-methyloxan-4-amine
CID 154471956
(2S)-2-[(sulfamoylamino)methyl]oxane
CID 155367087
Methanamine;2-methyloxan-4-amine
CID 156712849

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(sulfamoylamino)oxane?
The IUPAC name of 2-methyl-4-(sulfamoylamino)oxane (CID 103887477) is 2-methyl-4-(sulfamoylamino)oxane.
What is the SMILES notation for 2-methyl-4-(sulfamoylamino)oxane?
The canonical SMILES for 2-methyl-4-(sulfamoylamino)oxane is CC1CC(NS(N)(=O)=O)CCO1.
What is the InChIKey of 2-methyl-4-(sulfamoylamino)oxane?
The InChIKey is ZSTYEDPTCOOFHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-5-4-6(2-3-11-5)8-12(7,9)10/h5-6,8H,2-4H2,1H3,(H2,7,9,10).
What are the key properties of 2-methyl-4-(sulfamoylamino)oxane?
2-methyl-4-(sulfamoylamino)oxane has a molecular weight of 194.26 g/mol, XLogP of -0.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(sulfamoylamino)oxane is sourced from PubChem (CID 103887477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).