4-(methoxymethyl)oxan-4-amine

C7H15NO2 — CID 67225106

IUPAC4-(methoxymethyl)oxan-4-amine
SMILESCOCC1(N)CCOCC1
InChIInChI=1S/C7H15NO2/c1-9-6-7(8)2-4-10-5-3-7/h2-6,8H2,1H3
InChIKeyRKTQBNBFFHFZPT-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.14
Rot. Bonds2

About 4-(methoxymethyl)oxan-4-amine

4-(methoxymethyl)oxan-4-amine (PubChem CID 67225106) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 4-(methoxymethyl)oxan-4-amine.

Molecular Properties

Compound Name4-(methoxymethyl)oxan-4-amine
PubChem CID67225106
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name4-(methoxymethyl)oxan-4-amine
SMILESCOCC1(N)CCOCC1
InChIInChI=1S/C7H15NO2/c1-9-6-7(8)2-4-10-5-3-7/h2-6,8H2,1H3
InChIKeyRKTQBNBFFHFZPT-UHFFFAOYSA-N
XLogP0.14
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)oxan-4-amine?
The IUPAC name of 4-(methoxymethyl)oxan-4-amine (CID 67225106) is 4-(methoxymethyl)oxan-4-amine.
What is the SMILES notation for 4-(methoxymethyl)oxan-4-amine?
The canonical SMILES for 4-(methoxymethyl)oxan-4-amine is COCC1(N)CCOCC1.
What is the InChIKey of 4-(methoxymethyl)oxan-4-amine?
The InChIKey is RKTQBNBFFHFZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO2/c1-9-6-7(8)2-4-10-5-3-7/h2-6,8H2,1H3.
What are the key properties of 4-(methoxymethyl)oxan-4-amine?
4-(methoxymethyl)oxan-4-amine has a molecular weight of 145.20 g/mol, XLogP of 0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)oxan-4-amine is sourced from PubChem (CID 67225106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).