2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol

C15H15Cl2NO — CID 103845164

IUPAC2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol
SMILESOCCc1ccc(NCc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C15H15Cl2NO/c16-13-3-6-15(17)12(9-13)10-18-14-4-1-11(2-5-14)7-8-19/h1-6,9,18-19H,7-8,10H2
InChIKeyMDFHLFLNZMKDIO-UHFFFAOYSA-N
MW296.20 g/mol
LogP4.14
Rot. Bonds5

About 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol

2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol (PubChem CID 103845164) has the molecular formula C15H15Cl2NO and a molecular weight of 296.20 g/mol. Its IUPAC name is 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol.

Molecular Properties

Compound Name2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol
PubChem CID103845164
Molecular FormulaC15H15Cl2NO
Molecular Weight296.20 g/mol
Exact Mass295.05
IUPAC Name2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol
SMILESOCCc1ccc(NCc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C15H15Cl2NO/c16-13-3-6-15(17)12(9-13)10-18-14-4-1-11(2-5-14)7-8-19/h1-6,9,18-19H,7-8,10H2
InChIKeyMDFHLFLNZMKDIO-UHFFFAOYSA-N
XLogP4.14
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 ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]acetamide
CID 103844946
4-bromo-N-[(2,5-dichlorophenyl)methyl]aniline
CID 65315845
2-[4-[(2,3,6-trichlorophenyl)methylamino]phenyl]ethanol
CID 78968853
2-[4-[(4-chlorothiophen-2-yl)methylamino]phenyl]ethanol
CID 79419830
4-[(2,5-dichlorophenyl)methylamino]-N,N-dimethylbenzamide
CID 103696962
3-(chloromethyl)-N-[(2,5-dichlorophenyl)methyl]aniline
CID 65318262
2-[4-[(7-chloro-1,3-benzodioxol-5-yl)methylamino]phenyl]ethanol
CID 61236596
2-[4-[(2-bromophenyl)methylamino]phenyl]ethanol
CID 61236412
4-bromo-N-[(2,5-dichlorophenyl)methyl]-3-iodoaniline
CID 114259513
6-bromo-N-[(2,5-dichlorophenyl)methyl]naphthalen-2-amine
CID 81266419
2-[4-[(4-bromophenyl)methylamino]phenyl]ethanol
CID 61238413
2-[4-[(3-chloro-4,5-dimethoxyphenyl)methylamino]phenyl]ethanol
CID 110902664

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol?
The IUPAC name of 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol (CID 103845164) is 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol.
What is the SMILES notation for 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol?
The canonical SMILES for 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol is OCCc1ccc(NCc2cc(Cl)ccc2Cl)cc1.
What is the InChIKey of 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol?
The InChIKey is MDFHLFLNZMKDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO/c16-13-3-6-15(17)12(9-13)10-18-14-4-1-11(2-5-14)7-8-19/h1-6,9,18-19H,7-8,10H2.
What are the key properties of 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol?
2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol has a molecular weight of 296.20 g/mol, XLogP of 4.14, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2,5-dichlorophenyl)methylamino]phenyl]ethanol is sourced from PubChem (CID 103845164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).