O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine

C6H11NO3 — CID 123959878

IUPACO-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine
SMILESNOC1COC2OCCC12
InChIInChI=1S/C6H11NO3/c7-10-5-3-9-6-4(5)1-2-8-6/h4-6H,1-3,7H2
InChIKeyUSYLRMJOCQVPEU-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.36
Rot. Bonds1

About O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine

O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine (PubChem CID 123959878) has the molecular formula C6H11NO3 and a molecular weight of 145.16 g/mol. Its IUPAC name is O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine.

Molecular Properties

Compound NameO-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine
PubChem CID123959878
Molecular FormulaC6H11NO3
Molecular Weight145.16 g/mol
Exact Mass145.07
IUPAC NameO-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine
SMILESNOC1COC2OCCC12
InChIInChI=1S/C6H11NO3/c7-10-5-3-9-6-4(5)1-2-8-6/h4-6H,1-3,7H2
InChIKeyUSYLRMJOCQVPEU-UHFFFAOYSA-N
XLogP-0.36
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3aS,4R,6aR)-4-cyclobutyloxy-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
CID 163910669
[(4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl] formate
CID 59512802
(3aR,4S,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-amine
CID 97302678
(3aS,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol;(3aR,4R,6aS)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 159842811
(4R,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan
CID 58779336
(3aR,4R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 124524160
(3aS,4R)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol
CID 69459334
2,7-dioxabicyclo[3.2.0]heptane
CID 118053300
(3aS,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144802403
(3aR,6aS)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144768058
(3aR,6aR)-4-methyl-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan;ethane
CID 144768068
(3aS,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-ol;ethane
CID 142011906

Frequently Asked Questions

What is the IUPAC name of O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine?
The IUPAC name of O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine (CID 123959878) is O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine.
What is the SMILES notation for O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine?
The canonical SMILES for O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine is NOC1COC2OCCC12.
What is the InChIKey of O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine?
The InChIKey is USYLRMJOCQVPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3/c7-10-5-3-9-6-4(5)1-2-8-6/h4-6H,1-3,7H2.
What are the key properties of O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine?
O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine has a molecular weight of 145.16 g/mol, XLogP of -0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl)hydroxylamine is sourced from PubChem (CID 123959878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).