4-(aminomethyl)-4-(diethylsulfamoylamino)oxane

C10H23N3O3S — CID 114170091

IUPAC4-(aminomethyl)-4-(diethylsulfamoylamino)oxane
SMILESCCN(CC)S(=O)(=O)NC1(CN)CCOCC1
InChIInChI=1S/C10H23N3O3S/c1-3-13(4-2)17(14,15)12-10(9-11)5-7-16-8-6-10/h12H,3-9,11H2,1-2H3
InChIKeyKGTFBCAXCPDVTP-UHFFFAOYSA-N
MW265.38 g/mol
LogP-0.33
Rot. Bonds6

About 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane

4-(aminomethyl)-4-(diethylsulfamoylamino)oxane (PubChem CID 114170091) has the molecular formula C10H23N3O3S and a molecular weight of 265.38 g/mol. Its IUPAC name is 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane.

Molecular Properties

Compound Name4-(aminomethyl)-4-(diethylsulfamoylamino)oxane
PubChem CID114170091
Molecular FormulaC10H23N3O3S
Molecular Weight265.38 g/mol
Exact Mass265.15
IUPAC Name4-(aminomethyl)-4-(diethylsulfamoylamino)oxane
SMILESCCN(CC)S(=O)(=O)NC1(CN)CCOCC1
InChIInChI=1S/C10H23N3O3S/c1-3-13(4-2)17(14,15)12-10(9-11)5-7-16-8-6-10/h12H,3-9,11H2,1-2H3
InChIKeyKGTFBCAXCPDVTP-UHFFFAOYSA-N
XLogP-0.33
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane?
The IUPAC name of 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane (CID 114170091) is 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane.
What is the SMILES notation for 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane?
The canonical SMILES for 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane is CCN(CC)S(=O)(=O)NC1(CN)CCOCC1.
What is the InChIKey of 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane?
The InChIKey is KGTFBCAXCPDVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3S/c1-3-13(4-2)17(14,15)12-10(9-11)5-7-16-8-6-10/h12H,3-9,11H2,1-2H3.
What are the key properties of 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane?
4-(aminomethyl)-4-(diethylsulfamoylamino)oxane has a molecular weight of 265.38 g/mol, XLogP of -0.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-4-(diethylsulfamoylamino)oxane is sourced from PubChem (CID 114170091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).