2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol

C10H14FNO2 — CID 55276230

IUPAC2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol
SMILESCN[C@H](C)c1cc(F)c(O)c(OC)c1
InChIInChI=1S/C10H14FNO2/c1-6(12-2)7-4-8(11)10(13)9(5-7)14-3/h4-6,12-13H,1-3H3/t6-/m1/s1
InChIKeyTVRQKEWIAIGAAD-ZCFIWIBFSA-N
MW199.22 g/mol
LogP1.82
Rot. Bonds3

About 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol

2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol (PubChem CID 55276230) has the molecular formula C10H14FNO2 and a molecular weight of 199.22 g/mol. Its IUPAC name is 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol.

Molecular Properties

Compound Name2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol
PubChem CID55276230
Molecular FormulaC10H14FNO2
Molecular Weight199.22 g/mol
Exact Mass199.10
IUPAC Name2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol
SMILESCN[C@H](C)c1cc(F)c(O)c(OC)c1
InChIInChI=1S/C10H14FNO2/c1-6(12-2)7-4-8(11)10(13)9(5-7)14-3/h4-6,12-13H,1-3H3/t6-/m1/s1
InChIKeyTVRQKEWIAIGAAD-ZCFIWIBFSA-N
XLogP1.82
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol?
The IUPAC name of 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol (CID 55276230) is 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol.
What is the SMILES notation for 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol?
The canonical SMILES for 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol is CN[C@H](C)c1cc(F)c(O)c(OC)c1.
What is the InChIKey of 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol?
The InChIKey is TVRQKEWIAIGAAD-ZCFIWIBFSA-N. The full InChI is InChI=1S/C10H14FNO2/c1-6(12-2)7-4-8(11)10(13)9(5-7)14-3/h4-6,12-13H,1-3H3/t6-/m1/s1.
What are the key properties of 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol?
2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol has a molecular weight of 199.22 g/mol, XLogP of 1.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-methoxy-4-[(1R)-1-(methylamino)ethyl]phenol is sourced from PubChem (CID 55276230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).