3-[1-(4-bromophenyl)ethylamino]phenol

C14H14BrNO — CID 43206955

IUPAC3-[1-(4-bromophenyl)ethylamino]phenol
SMILESCC(Nc1cccc(O)c1)c1ccc(Br)cc1
InChIInChI=1S/C14H14BrNO/c1-10(11-5-7-12(15)8-6-11)16-13-3-2-4-14(17)9-13/h2-10,16-17H,1H3
InChIKeySKVJXEIWAHGPLV-UHFFFAOYSA-N
MW292.18 g/mol
LogP4.33
Rot. Bonds3

About 3-[1-(4-bromophenyl)ethylamino]phenol

3-[1-(4-bromophenyl)ethylamino]phenol (PubChem CID 43206955) has the molecular formula C14H14BrNO and a molecular weight of 292.18 g/mol. Its IUPAC name is 3-[1-(4-bromophenyl)ethylamino]phenol.

Molecular Properties

Compound Name3-[1-(4-bromophenyl)ethylamino]phenol
PubChem CID43206955
Molecular FormulaC14H14BrNO
Molecular Weight292.18 g/mol
Exact Mass291.03
IUPAC Name3-[1-(4-bromophenyl)ethylamino]phenol
SMILESCC(Nc1cccc(O)c1)c1ccc(Br)cc1
InChIInChI=1S/C14H14BrNO/c1-10(11-5-7-12(15)8-6-11)16-13-3-2-4-14(17)9-13/h2-10,16-17H,1H3
InChIKeySKVJXEIWAHGPLV-UHFFFAOYSA-N
XLogP4.33
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-(4-methoxyphenyl)ethylamino]phenol
CID 43206982
3-N-[1-(4-bromophenyl)ethyl]benzene-1,3-diamine
CID 54965501
3-[1-(4-propan-2-yloxyphenyl)ethylamino]phenol
CID 43207017
3-[1-(4-bromophenyl)ethylamino]benzoic acid
CID 43139392
1-N-[1-(4-bromophenyl)ethyl]-3-N,3-N-dimethylbenzene-1,3-diamine
CID 115375943
3-[1-(4-nitrophenyl)ethylamino]phenol
CID 43297394
3-[1-(4-bromophenyl)ethylamino]benzenesulfonamide
CID 43102327
N-[1-(4-bromophenyl)ethyl]naphthalen-2-amine
CID 43680266
3-[1-(4-hydroxyphenyl)ethylamino]benzamide
CID 43202853
3-bromo-N-[(1S)-1-phenylethyl]aniline;hydrochloride
CID 172882994
ethyl 3-[1-(4-bromophenyl)ethylamino]benzoate
CID 43321951
3-[1-(3-bromothiophen-2-yl)ethylamino]phenol
CID 43771069

Frequently Asked Questions

What is the IUPAC name of 3-[1-(4-bromophenyl)ethylamino]phenol?
The IUPAC name of 3-[1-(4-bromophenyl)ethylamino]phenol (CID 43206955) is 3-[1-(4-bromophenyl)ethylamino]phenol.
What is the SMILES notation for 3-[1-(4-bromophenyl)ethylamino]phenol?
The canonical SMILES for 3-[1-(4-bromophenyl)ethylamino]phenol is CC(Nc1cccc(O)c1)c1ccc(Br)cc1.
What is the InChIKey of 3-[1-(4-bromophenyl)ethylamino]phenol?
The InChIKey is SKVJXEIWAHGPLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO/c1-10(11-5-7-12(15)8-6-11)16-13-3-2-4-14(17)9-13/h2-10,16-17H,1H3.
What are the key properties of 3-[1-(4-bromophenyl)ethylamino]phenol?
3-[1-(4-bromophenyl)ethylamino]phenol has a molecular weight of 292.18 g/mol, XLogP of 4.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(4-bromophenyl)ethylamino]phenol is sourced from PubChem (CID 43206955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).