2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine

C12H17NO2 — CID 104674319

IUPAC2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine
SMILESCNC1CC(Oc2ccccc2)C1OC
InChIInChI=1S/C12H17NO2/c1-13-10-8-11(12(10)14-2)15-9-6-4-3-5-7-9/h3-7,10-13H,8H2,1-2H3
InChIKeyGHFLVVIRCOHMTI-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.44
Rot. Bonds4

About 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine

2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine (PubChem CID 104674319) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine
PubChem CID104674319
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine
SMILESCNC1CC(Oc2ccccc2)C1OC
InChIInChI=1S/C12H17NO2/c1-13-10-8-11(12(10)14-2)15-9-6-4-3-5-7-9/h3-7,10-13H,8H2,1-2H3
InChIKeyGHFLVVIRCOHMTI-UHFFFAOYSA-N
XLogP1.44
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine (CID 104674319) is 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine is CNC1CC(Oc2ccccc2)C1OC.
What is the InChIKey of 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine?
The InChIKey is GHFLVVIRCOHMTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-13-10-8-11(12(10)14-2)15-9-6-4-3-5-7-9/h3-7,10-13H,8H2,1-2H3.
What are the key properties of 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine?
2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine has a molecular weight of 207.27 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-3-phenoxycyclobutan-1-amine is sourced from PubChem (CID 104674319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).