2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol

C15H15Cl2NO — CID 63182715

IUPAC2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol
SMILESOCC(NCc1c(Cl)cccc1Cl)c1ccccc1
InChIInChI=1S/C15H15Cl2NO/c16-13-7-4-8-14(17)12(13)9-18-15(10-19)11-5-2-1-3-6-11/h1-8,15,18-19H,9-10H2
InChIKeyDGHRMIRLKGOKDX-UHFFFAOYSA-N
MW296.20 g/mol
LogP3.82
Rot. Bonds5

About 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol

2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol (PubChem CID 63182715) has the molecular formula C15H15Cl2NO and a molecular weight of 296.20 g/mol. Its IUPAC name is 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol.

Molecular Properties

Compound Name2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol
PubChem CID63182715
Molecular FormulaC15H15Cl2NO
Molecular Weight296.20 g/mol
Exact Mass295.05
IUPAC Name2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol
SMILESOCC(NCc1c(Cl)cccc1Cl)c1ccccc1
InChIInChI=1S/C15H15Cl2NO/c16-13-7-4-8-14(17)12(13)9-18-15(10-19)11-5-2-1-3-6-11/h1-8,15,18-19H,9-10H2
InChIKeyDGHRMIRLKGOKDX-UHFFFAOYSA-N
XLogP3.82
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-phenyl-2-[(2,3,6-trichlorophenyl)methylamino]ethanol
CID 107862655
(2R)-2-[(2,3-dichlorophenyl)methylamino]-2-phenylethanol
CID 95026876
2-[(4-chloro-2-fluorophenyl)methylamino]-2-phenylethanol
CID 114750493
(1S)-N-[(2,6-dichlorophenyl)methyl]-1-phenylethanamine
CID 961193
2-(benzylamino)-2-(4-chlorophenyl)ethanol
CID 61046547
(2R)-2-[(4-bromo-2-chlorophenyl)methylamino]-2-phenylethanol
CID 103766322
2-[(2,6-dichlorophenyl)methylamino]-3-phenylpropan-1-ol
CID 63260434
2-[(5-chloro-2-pyridinyl)methylamino]-2-phenylethanol
CID 110013489
2-[(2-bromophenyl)methylamino]-2-phenylethanol
CID 6613037
(2R)-2-[(2-bromo-5-chlorophenyl)methylamino]-2-phenylethanol
CID 103766335
(2R)-2-[(3-chloro-1H-indol-2-yl)methylamino]-2-phenylethanol
CID 107862609
3-chloro-2-[[(2-methyl-1-phenylpropyl)amino]methyl]phenol
CID 78959543

Frequently Asked Questions

What is the IUPAC name of 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol?
The IUPAC name of 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol (CID 63182715) is 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol.
What is the SMILES notation for 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol?
The canonical SMILES for 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol is OCC(NCc1c(Cl)cccc1Cl)c1ccccc1.
What is the InChIKey of 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol?
The InChIKey is DGHRMIRLKGOKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO/c16-13-7-4-8-14(17)12(13)9-18-15(10-19)11-5-2-1-3-6-11/h1-8,15,18-19H,9-10H2.
What are the key properties of 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol?
2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol has a molecular weight of 296.20 g/mol, XLogP of 3.82, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,6-dichlorophenyl)methylamino]-2-phenylethanol is sourced from PubChem (CID 63182715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).