1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine

C11H16FNO — CID 84733466

IUPAC1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1cc(F)ccc1OC
InChIInChI=1S/C11H16FNO/c1-8(13-2)6-9-7-10(12)4-5-11(9)14-3/h4-5,7-8,13H,6H2,1-3H3
InChIKeyRUXNNPYLPXFLHD-UHFFFAOYSA-N
MW197.25 g/mol
LogP1.98
Rot. Bonds4

About 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine

1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine (PubChem CID 84733466) has the molecular formula C11H16FNO and a molecular weight of 197.25 g/mol. Its IUPAC name is 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine
PubChem CID84733466
Molecular FormulaC11H16FNO
Molecular Weight197.25 g/mol
Exact Mass197.12
IUPAC Name1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine
SMILESCNC(C)Cc1cc(F)ccc1OC
InChIInChI=1S/C11H16FNO/c1-8(13-2)6-9-7-10(12)4-5-11(9)14-3/h4-5,7-8,13H,6H2,1-3H3
InChIKeyRUXNNPYLPXFLHD-UHFFFAOYSA-N
XLogP1.98
TPSA21.26 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 ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-tert-butyl-2-methoxyphenyl)-N-methylpropan-2-amine
CID 82262287
1-[4-(5-fluoro-2-methoxyphenyl)phenyl]-N-methylpropan-2-amine
CID 82540192
1-(5-fluoro-2-methoxyphenyl)-2-(2-methoxyphenyl)-N-methylethanamine
CID 43485635
1-(4-fluoro-2-methylphenyl)-2-(2-methoxy-5-methylphenyl)-N-methylethanamine
CID 81267976
1-(4-fluoro-3-methoxyphenyl)-N-methylpropan-2-amine
CID 69036284
1-(2-bromo-3-methoxyphenyl)-N-methylpropan-2-amine
CID 84738148
2-methoxy-6-[2-(methylamino)propyl]phenol
CID 68884486
1-(5-fluoro-1H-indol-3-yl)-N-methylpropan-2-amine
CID 117195576
1-(5-fluoro-2-nitrophenyl)-N-methylpropan-2-amine
CID 63199917
(5-fluoro-2-methoxyphenyl)methanethiol
CID 24688819
(5-fluoro-2-methoxyphenyl)methanamine
CID 18348829
1-(2-ethoxy-5-fluorophenyl)propan-2-amine
CID 55254144

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine?
The IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine (CID 84733466) is 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine is CNC(C)Cc1cc(F)ccc1OC.
What is the InChIKey of 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine?
The InChIKey is RUXNNPYLPXFLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO/c1-8(13-2)6-9-7-10(12)4-5-11(9)14-3/h4-5,7-8,13H,6H2,1-3H3.
What are the key properties of 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine?
1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine has a molecular weight of 197.25 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methoxyphenyl)-N-methylpropan-2-amine is sourced from PubChem (CID 84733466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).