4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride

C14H15Cl2NO — CID 163801229

IUPAC4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride
SMILESCl.NCCc1ccc(O)c(-c2ccccc2Cl)c1
InChIInChI=1S/C14H14ClNO.ClH/c15-13-4-2-1-3-11(13)12-9-10(7-8-16)5-6-14(12)17;/h1-6,9,17H,7-8,16H2;1H
InChIKeyBNNYKWZJITWUMB-UHFFFAOYSA-N
MW284.19 g/mol
LogP3.64
Rot. Bonds3

About 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride

4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride (PubChem CID 163801229) has the molecular formula C14H15Cl2NO and a molecular weight of 284.19 g/mol. Its IUPAC name is 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride.

Molecular Properties

Compound Name4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride
PubChem CID163801229
Molecular FormulaC14H15Cl2NO
Molecular Weight284.19 g/mol
Exact Mass283.05
IUPAC Name4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride
SMILESCl.NCCc1ccc(O)c(-c2ccccc2Cl)c1
InChIInChI=1S/C14H14ClNO.ClH/c15-13-4-2-1-3-11(13)12-9-10(7-8-16)5-6-14(12)17;/h1-6,9,17H,7-8,16H2;1H
InChIKeyBNNYKWZJITWUMB-UHFFFAOYSA-N
XLogP3.64
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-(2-aminoethyl)-2-chlorophenyl]phenol
CID 115046200
4-(2-aminoethyl)-2-chlorophenol;hydrobromide
CID 67045103
2-[5-(2-aminoethyl)-2-methylphenyl]phenol
CID 115036237
CID 159860777
CID 159860777
4-(2-aminoethyl)benzene-1,2-diol;nickel
CID 175198518
4-(2-aminoethyl)benzene-1,2-diol;methane
CID 175755753
2-(2-chloro-4-hexylphenyl)-5-(2-chlorophenyl)benzene-1,4-diol
CID 16741909
4-(2-aminoethyl)-2-(3,4-difluorophenyl)phenol
CID 82296847
strontium;4-(2-aminoethyl)benzene-1,2-diol;hydride
CID 174942711
2-[4-chloro-3-(4-methylphenyl)phenyl]ethanamine
CID 115045738
4-(2-aminoethyl)-2-(aminomethyl)phenol
CID 105433039
5-(2-aminoethyl)-2-(2-hydroxyphenyl)peroxyphenol
CID 154990277

Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride?
The IUPAC name of 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride (CID 163801229) is 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride.
What is the SMILES notation for 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride?
The canonical SMILES for 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride is Cl.NCCc1ccc(O)c(-c2ccccc2Cl)c1.
What is the InChIKey of 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride?
The InChIKey is BNNYKWZJITWUMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClNO.ClH/c15-13-4-2-1-3-11(13)12-9-10(7-8-16)5-6-14(12)17;/h1-6,9,17H,7-8,16H2;1H.
What are the key properties of 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride?
4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride has a molecular weight of 284.19 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-2-(2-chlorophenyl)phenol;hydrochloride is sourced from PubChem (CID 163801229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).