1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine

C11H16FNO — CID 64538007

IUPAC1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine
SMILESCC(C)(N)COCc1ccccc1F
InChIInChI=1S/C11H16FNO/c1-11(2,13)8-14-7-9-5-3-4-6-10(9)12/h3-6H,7-8,13H2,1-2H3
InChIKeyNBABINUZGFDGSO-UHFFFAOYSA-N
MW197.25 g/mol
LogP2.08
Rot. Bonds4

About 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine

1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine (PubChem CID 64538007) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine
PubChem CID64538007
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine
SMILESCC(C)(N)COCc1ccccc1F
InChIInChI=1S/C11H16FNO/c1-11(2,13)8-14-7-9-5-3-4-6-10(9)12/h3-6H,7-8,13H2,1-2H3
InChIKeyNBABINUZGFDGSO-UHFFFAOYSA-N
XLogP2.08
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine?
The IUPAC name of 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine (CID 64538007) is 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine.
What is the SMILES notation for 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine?
The canonical SMILES for 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine is CC(C)(N)COCc1ccccc1F.
What is the InChIKey of 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine?
The InChIKey is NBABINUZGFDGSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-11(2,13)8-14-7-9-5-3-4-6-10(9)12/h3-6H,7-8,13H2,1-2H3.
What are the key properties of 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine?
1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine has a molecular weight of 197.25 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methoxy]-2-methylpropan-2-amine is sourced from PubChem (CID 64538007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).