2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol

C10H13BrFNO — CID 84807013

IUPAC2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol
SMILESCC(C)(N)Cc1cc(F)cc(Br)c1O
InChIInChI=1S/C10H13BrFNO/c1-10(2,13)5-6-3-7(12)4-8(11)9(6)14/h3-4,14H,5,13H2,1-2H3
InChIKeyNAABYPFEKWODNR-UHFFFAOYSA-N
MW262.12 g/mol
LogP2.57
Rot. Bonds2

About 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol

2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol (PubChem CID 84807013) has the molecular formula C10H13BrFNO and a molecular weight of 262.12 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol.

Molecular Properties

Compound Name2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol
PubChem CID84807013
Molecular FormulaC10H13BrFNO
Molecular Weight262.12 g/mol
Exact Mass261.02
IUPAC Name2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol
SMILESCC(C)(N)Cc1cc(F)cc(Br)c1O
InChIInChI=1S/C10H13BrFNO/c1-10(2,13)5-6-3-7(12)4-8(11)9(6)14/h3-4,14H,5,13H2,1-2H3
InChIKeyNAABYPFEKWODNR-UHFFFAOYSA-N
XLogP2.57
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.12
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-bromo-5-fluoro-2-methylphenyl)-2-methylpropan-2-amine
CID 117404058
6-(2-amino-2-methylpropyl)-2-bromo-3,4-difluorophenol
CID 84811709
2-bromo-4-fluoro-6-(2-hydroxypropyl)phenol
CID 117375107
2-(2-aminobutan-2-yl)-6-bromo-4-fluorophenol
CID 130134190
2-methyl-1-(2,3,5-trifluorophenyl)propan-2-amine
CID 117112050
1-(4-bromo-2-fluoro-5-methoxyphenyl)-2-methylpropan-2-amine
CID 84810981
4-(2-amino-2-methylpropyl)-2-chloro-6-fluorobenzene-1,3-diol
CID 84796627
2-bromo-4-fluoro-6-[2-(methylamino)ethyl]phenol
CID 83900216
2-bromo-4-fluoro-6-methoxyphenol
CID 58419882
1-(2-chloro-3,5-difluorophenyl)-2-methylpropan-2-amine
CID 117313615
6-(2-amino-2-methylpropyl)-4-bromo-3-methoxy-2-methylphenol
CID 117465337
4-(2-amino-2-methylpropyl)-2-bromo-5-methylphenol
CID 117398550

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol?
The IUPAC name of 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol (CID 84807013) is 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol.
What is the SMILES notation for 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol?
The canonical SMILES for 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol is CC(C)(N)Cc1cc(F)cc(Br)c1O.
What is the InChIKey of 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol?
The InChIKey is NAABYPFEKWODNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrFNO/c1-10(2,13)5-6-3-7(12)4-8(11)9(6)14/h3-4,14H,5,13H2,1-2H3.
What are the key properties of 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol?
2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol has a molecular weight of 262.12 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropyl)-6-bromo-4-fluorophenol is sourced from PubChem (CID 84807013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).