4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol

C10H14FNO — CID 84659130

IUPAC4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol
SMILESCNCCc1cc(CF)ccc1O
InChIInChI=1S/C10H14FNO/c1-12-5-4-9-6-8(7-11)2-3-10(9)13/h2-3,6,12-13H,4-5,7H2,1H3
InChIKeyRMYYTEFVRZOUSJ-UHFFFAOYSA-N
MW183.23 g/mol
LogP1.62
Rot. Bonds4

About 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol

4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol (PubChem CID 84659130) has the molecular formula C10H14FNO and a molecular weight of 183.23 g/mol. Its IUPAC name is 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol.

Molecular Properties

Compound Name4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol
PubChem CID84659130
Molecular FormulaC10H14FNO
Molecular Weight183.23 g/mol
Exact Mass183.11
IUPAC Name4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol
SMILESCNCCc1cc(CF)ccc1O
InChIInChI=1S/C10H14FNO/c1-12-5-4-9-6-8(7-11)2-3-10(9)13/h2-3,6,12-13H,4-5,7H2,1H3
InChIKeyRMYYTEFVRZOUSJ-UHFFFAOYSA-N
XLogP1.62
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.23
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[5-(fluoromethyl)-2-hydroxyphenyl]propanoic acid
CID 84668107
ethane;2-fluoro-4-[2-(methylamino)ethyl]phenol
CID 155581862
2-[2-(methylamino)ethyl]-4-phenoxyphenol
CID 82552120
fluoro-methyl-tritio-λ3-iodane;4-[2-(methylamino)ethyl]benzene-1,2-diol
CID 158050846
[5-(fluoromethyl)-2-methylphenyl]methanol
CID 84649942
2-[3-fluoro-5-(fluoromethyl)-2-methoxyphenyl]-N-methylethanamine
CID 117306682
2-butyl-4-[(3-butyl-4-hydroxyphenyl)methyl]phenol
CID 121386327
4-[3-(methylamino)propyl]benzene-1,2-diol
CID 14515291
[4,5-dihydroxy-2-[2-(methylamino)ethyl]phenyl] thiohypofluorite
CID 153354066
4-(fluoromethyl)-2-methoxyphenol
CID 84650348
2,5-dimethyl-4-[2-(methylamino)ethyl]phenol
CID 58911397
4-[5-(fluoromethyl)-2-methylphenyl]butanoic acid
CID 117300398

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol?
The IUPAC name of 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol (CID 84659130) is 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol.
What is the SMILES notation for 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol?
The canonical SMILES for 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol is CNCCc1cc(CF)ccc1O.
What is the InChIKey of 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol?
The InChIKey is RMYYTEFVRZOUSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNO/c1-12-5-4-9-6-8(7-11)2-3-10(9)13/h2-3,6,12-13H,4-5,7H2,1H3.
What are the key properties of 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol?
4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol has a molecular weight of 183.23 g/mol, XLogP of 1.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-2-[2-(methylamino)ethyl]phenol is sourced from PubChem (CID 84659130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).