2-amino-1-[3-(4-methylphenyl)phenyl]ethanol

C15H17NO — CID 82287999

IUPAC2-amino-1-[3-(4-methylphenyl)phenyl]ethanol
SMILESCc1ccc(-c2cccc(C(O)CN)c2)cc1
InChIInChI=1S/C15H17NO/c1-11-5-7-12(8-6-11)13-3-2-4-14(9-13)15(17)10-16/h2-9,15,17H,10,16H2,1H3
InChIKeyDDZGHJGLEWZMNV-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.65
Rot. Bonds3

About 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol

2-amino-1-[3-(4-methylphenyl)phenyl]ethanol (PubChem CID 82287999) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol.

Molecular Properties

Compound Name2-amino-1-[3-(4-methylphenyl)phenyl]ethanol
PubChem CID82287999
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name2-amino-1-[3-(4-methylphenyl)phenyl]ethanol
SMILESCc1ccc(-c2cccc(C(O)CN)c2)cc1
InChIInChI=1S/C15H17NO/c1-11-5-7-12(8-6-11)13-3-2-4-14(9-13)15(17)10-16/h2-9,15,17H,10,16H2,1H3
InChIKeyDDZGHJGLEWZMNV-UHFFFAOYSA-N
XLogP2.65
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-1-(4-methylphenyl)ethanol;ethane
CID 145260878
N-[3-(2-amino-1-hydroxyethyl)phenyl]-4-methylbenzenesulfonamide
CID 25046021
1-(1-fluoroethyl)-3-(4-methylphenyl)benzene
CID 170974914
4-[3-[4-[4-(4-methylphenyl)phenyl]phenyl]phenyl]aniline
CID 131995519
2-amino-1-phenylethanol;ethane
CID 91425169
[3-(4-methylphenyl)phenyl]methanamine
CID 1392243
2-amino-1-[3-(diethylamino)phenyl]ethanol
CID 117297990
(1S)-2-amino-1-(3-nitrophenyl)ethanol
CID 55264567
2-amino-1-[3-(1,1-difluoro-2-methylpropyl)phenyl]ethanol
CID 116992716
2-amino-1-[3-(trifluoromethyl)phenyl]ethanol
CID 30514
2-amino-1-[4-(3,4-difluorophenyl)phenyl]ethanol
CID 82296845
(1R)-1-[3-[3-[(1R)-1-hydroxyethyl]phenyl]phenyl]ethanol
CID 15321486

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol?
The IUPAC name of 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol (CID 82287999) is 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol.
What is the SMILES notation for 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol?
The canonical SMILES for 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol is Cc1ccc(-c2cccc(C(O)CN)c2)cc1.
What is the InChIKey of 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol?
The InChIKey is DDZGHJGLEWZMNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11-5-7-12(8-6-11)13-3-2-4-14(9-13)15(17)10-16/h2-9,15,17H,10,16H2,1H3.
What are the key properties of 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol?
2-amino-1-[3-(4-methylphenyl)phenyl]ethanol has a molecular weight of 227.31 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[3-(4-methylphenyl)phenyl]ethanol is sourced from PubChem (CID 82287999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).