N-(oxetan-3-yl)oxan-4-amine

C8H15NO2 — CID 63622356

IUPACN-(oxetan-3-yl)oxan-4-amine
SMILESC1CC(NC2COC2)CCO1
InChIInChI=1S/C8H15NO2/c1-3-10-4-2-7(1)9-8-5-11-6-8/h7-9H,1-6H2
InChIKeyVLTVCFSSRRWWPW-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.15
Rot. Bonds2

About N-(oxetan-3-yl)oxan-4-amine

N-(oxetan-3-yl)oxan-4-amine (PubChem CID 63622356) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-(oxetan-3-yl)oxan-4-amine.

Molecular Properties

Compound NameN-(oxetan-3-yl)oxan-4-amine
PubChem CID63622356
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-(oxetan-3-yl)oxan-4-amine
SMILESC1CC(NC2COC2)CCO1
InChIInChI=1S/C8H15NO2/c1-3-10-4-2-7(1)9-8-5-11-6-8/h7-9H,1-6H2
InChIKeyVLTVCFSSRRWWPW-UHFFFAOYSA-N
XLogP0.15
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(oxetan-3-yl)oxan-4-amine?
The IUPAC name of N-(oxetan-3-yl)oxan-4-amine (CID 63622356) is N-(oxetan-3-yl)oxan-4-amine.
What is the SMILES notation for N-(oxetan-3-yl)oxan-4-amine?
The canonical SMILES for N-(oxetan-3-yl)oxan-4-amine is C1CC(NC2COC2)CCO1.
What is the InChIKey of N-(oxetan-3-yl)oxan-4-amine?
The InChIKey is VLTVCFSSRRWWPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-10-4-2-7(1)9-8-5-11-6-8/h7-9H,1-6H2.
What are the key properties of N-(oxetan-3-yl)oxan-4-amine?
N-(oxetan-3-yl)oxan-4-amine has a molecular weight of 157.21 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxetan-3-yl)oxan-4-amine is sourced from PubChem (CID 63622356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).