[4-(1-phenylethylamino)phenyl]methanol

C15H17NO — CID 112706513

IUPAC[4-(1-phenylethylamino)phenyl]methanol
SMILESCC(Nc1ccc(CO)cc1)c1ccccc1
InChIInChI=1S/C15H17NO/c1-12(14-5-3-2-4-6-14)16-15-9-7-13(11-17)8-10-15/h2-10,12,16-17H,11H2,1H3
InChIKeyKJCJMJOZALIRJY-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.35
Rot. Bonds4

About [4-(1-phenylethylamino)phenyl]methanol

[4-(1-phenylethylamino)phenyl]methanol (PubChem CID 112706513) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is [4-(1-phenylethylamino)phenyl]methanol.

Molecular Properties

Compound Name[4-(1-phenylethylamino)phenyl]methanol
PubChem CID112706513
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name[4-(1-phenylethylamino)phenyl]methanol
SMILESCC(Nc1ccc(CO)cc1)c1ccccc1
InChIInChI=1S/C15H17NO/c1-12(14-5-3-2-4-6-14)16-15-9-7-13(11-17)8-10-15/h2-10,12,16-17H,11H2,1H3
InChIKeyKJCJMJOZALIRJY-UHFFFAOYSA-N
XLogP3.35
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-phenylethyl)-4-propylaniline
CID 43078217
5-[1-[4-(hydroxymethyl)anilino]ethyl]benzene-1,3-diol
CID 107707113
N-[1-(4-ethylphenyl)ethyl]aniline
CID 43190038
4-N-[(1R)-1-phenylethyl]benzene-1,4-diamine
CID 28902579
2-[4-[1-(4-propan-2-ylphenyl)ethylamino]phenyl]ethanol
CID 61236945
2-[4-[1-(4-methylphenyl)ethylamino]phenyl]ethanol
CID 61238927
methyl 4-(1-phenylethylamino)benzoate
CID 43217232
4-(methylsulfanylmethyl)-N-[4-(1-phenylethylamino)phenyl]benzamide
CID 55986022
1,1,1,3,3,3-hexafluoro-2-[4-(1-phenylethylamino)phenyl]propan-2-ol
CID 20792423
2-[4-[1-(4-fluorophenyl)ethylamino]phenyl]ethanol
CID 61236407
3,4-dichloro-N-(1-phenylethyl)aniline
CID 43082168
propan-2-yl 4-(1-phenylethylamino)benzoate
CID 43226962

Frequently Asked Questions

What is the IUPAC name of [4-(1-phenylethylamino)phenyl]methanol?
The IUPAC name of [4-(1-phenylethylamino)phenyl]methanol (CID 112706513) is [4-(1-phenylethylamino)phenyl]methanol.
What is the SMILES notation for [4-(1-phenylethylamino)phenyl]methanol?
The canonical SMILES for [4-(1-phenylethylamino)phenyl]methanol is CC(Nc1ccc(CO)cc1)c1ccccc1.
What is the InChIKey of [4-(1-phenylethylamino)phenyl]methanol?
The InChIKey is KJCJMJOZALIRJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-12(14-5-3-2-4-6-14)16-15-9-7-13(11-17)8-10-15/h2-10,12,16-17H,11H2,1H3.
What are the key properties of [4-(1-phenylethylamino)phenyl]methanol?
[4-(1-phenylethylamino)phenyl]methanol has a molecular weight of 227.31 g/mol, XLogP of 3.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-phenylethylamino)phenyl]methanol is sourced from PubChem (CID 112706513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).