3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol

C10H14FNO — CID 84659080

IUPAC3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol
SMILESCNCCc1c(O)ccc(C)c1F
InChIInChI=1S/C10H14FNO/c1-7-3-4-9(13)8(10(7)11)5-6-12-2/h3-4,12-13H,5-6H2,1-2H3
InChIKeyHXHMFSSTRJKBQY-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.60
Rot. Bonds3

About 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol

3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol (PubChem CID 84659080) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol.

Molecular Properties

Compound Name3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol
PubChem CID84659080
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol
SMILESCNCCc1c(O)ccc(C)c1F
InChIInChI=1S/C10H14FNO/c1-7-3-4-9(13)8(10(7)11)5-6-12-2/h3-4,12-13H,5-6H2,1-2H3
InChIKeyHXHMFSSTRJKBQY-UHFFFAOYSA-N
XLogP1.60
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-fluoro-3-methyl-2-[2-(methylamino)ethyl]phenol
CID 84659094
3-(2-fluoro-6-hydroxy-3-methylphenyl)propanoic acid
CID 84668059
3-fluoro-4-methyl-2-(sulfanylmethyl)phenol
CID 174607030
2,4,5-trifluoro-3-[2-(methylamino)ethyl]phenol
CID 117293116
3,4,6-trifluoro-2-[2-(methylamino)ethyl]phenol
CID 117293117
3-bromo-6-methyl-2-[2-(methylamino)ethyl]phenol
CID 84802437
ethane;2-fluoro-4-[2-(methylamino)ethyl]phenol
CID 155581862
2-(3,6-dichloro-2-fluorophenyl)-N-methylethanamine
CID 84687329
4-bromo-5-fluoro-3-[2-(methylamino)ethyl]benzene-1,2-diol
CID 117414379
2-fluoro-4-methyl-3-(2-methylpropyl)phenol
CID 130177584
3-fluoro-4-methyl-2-(piperidin-4-ylmethyl)phenol
CID 84789130
2-bromo-3,5-dimethyl-6-[2-(methylamino)ethyl]phenol
CID 84709440

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol?
The IUPAC name of 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol (CID 84659080) is 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol.
What is the SMILES notation for 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol?
The canonical SMILES for 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol is CNCCc1c(O)ccc(C)c1F.
What is the InChIKey of 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol?
The InChIKey is HXHMFSSTRJKBQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-7-3-4-9(13)8(10(7)11)5-6-12-2/h3-4,12-13H,5-6H2,1-2H3.
What are the key properties of 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol?
3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol has a molecular weight of 183.23 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-methyl-2-[2-(methylamino)ethyl]phenol is sourced from PubChem (CID 84659080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).