[3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine

C7H14FNO — CID 105429049

IUPAC[3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine
SMILESCC(C)(F)C1(CN)COC1
InChIInChI=1S/C7H14FNO/c1-6(2,8)7(3-9)4-10-5-7/h3-5,9H2,1-2H3
InChIKeyPFOZESNAKJAYJG-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.71
Rot. Bonds2

About [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine

[3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine (PubChem CID 105429049) has the molecular formula C7H14FNO and a molecular weight of 147.19 g/mol. Its IUPAC name is [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine.

Molecular Properties

Compound Name[3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine
PubChem CID105429049
Molecular FormulaC7H14FNO
Molecular Weight147.19 g/mol
Exact Mass147.11
IUPAC Name[3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine
SMILESCC(C)(F)C1(CN)COC1
InChIInChI=1S/C7H14FNO/c1-6(2,8)7(3-9)4-10-5-7/h3-5,9H2,1-2H3
InChIKeyPFOZESNAKJAYJG-UHFFFAOYSA-N
XLogP0.71
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine?
The IUPAC name of [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine (CID 105429049) is [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine.
What is the SMILES notation for [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine?
The canonical SMILES for [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine is CC(C)(F)C1(CN)COC1.
What is the InChIKey of [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine?
The InChIKey is PFOZESNAKJAYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14FNO/c1-6(2,8)7(3-9)4-10-5-7/h3-5,9H2,1-2H3.
What are the key properties of [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine?
[3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine has a molecular weight of 147.19 g/mol, XLogP of 0.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-fluoropropan-2-yl)oxetan-3-yl]methanamine is sourced from PubChem (CID 105429049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).