[2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol

C14H13Cl2NO — CID 43229623

IUPAC[2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol
SMILESOCc1ccccc1NCc1c(Cl)cccc1Cl
InChIInChI=1S/C14H13Cl2NO/c15-12-5-3-6-13(16)11(12)8-17-14-7-2-1-4-10(14)9-18/h1-7,17-18H,8-9H2
InChIKeyNXUPDTMYBLZVKZ-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.10
Rot. Bonds4

About [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol

[2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol (PubChem CID 43229623) has the molecular formula C14H13Cl2NO and a molecular weight of 282.17 g/mol. Its IUPAC name is [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol.

Molecular Properties

Compound Name[2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol
PubChem CID43229623
Molecular FormulaC14H13Cl2NO
Molecular Weight282.17 g/mol
Exact Mass281.04
IUPAC Name[2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol
SMILESOCc1ccccc1NCc1c(Cl)cccc1Cl
InChIInChI=1S/C14H13Cl2NO/c15-12-5-3-6-13(16)11(12)8-17-14-7-2-1-4-10(14)9-18/h1-7,17-18H,8-9H2
InChIKeyNXUPDTMYBLZVKZ-UHFFFAOYSA-N
XLogP4.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,6-dichlorophenyl)methyl]-2-(methoxymethyl)aniline
CID 43677929
[2-[(4-chlorophenyl)methylamino]phenyl]methanol
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2-[[2-(hydroxymethyl)anilino]methyl]phenol
CID 43743175
2,6-dichloro-N-[2-(hydroxymethyl)phenyl]benzenesulfonamide
CID 53352077
3-chloro-2-[(2-propylanilino)methyl]phenol
CID 114317993
3-[[2-(hydroxymethyl)anilino]methyl]benzene-1,2-diol
CID 61318684
1-(2-chlorophenyl)-3-[2-(hydroxymethyl)phenyl]thiourea
CID 23737685
[2-[(2,4,5-trifluorophenyl)methylamino]phenyl]methanol
CID 103818098
N-[(2-chloro-6-methylsulfonylphenyl)methyl]-2-ethylaniline
CID 83169174
2-tert-butyl-N-[(2,6-dichlorophenyl)methyl]aniline
CID 43229696
3-chloro-2-[(2-iodoanilino)methyl]phenol
CID 113276494
2-(chloromethyl)-N-[(2,3-dichlorophenyl)methyl]aniline
CID 107309995

Frequently Asked Questions

What is the IUPAC name of [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol?
The IUPAC name of [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol (CID 43229623) is [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol.
What is the SMILES notation for [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol?
The canonical SMILES for [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol is OCc1ccccc1NCc1c(Cl)cccc1Cl.
What is the InChIKey of [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol?
The InChIKey is NXUPDTMYBLZVKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO/c15-12-5-3-6-13(16)11(12)8-17-14-7-2-1-4-10(14)9-18/h1-7,17-18H,8-9H2.
What are the key properties of [2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol?
[2-[(2,6-dichlorophenyl)methylamino]phenyl]methanol has a molecular weight of 282.17 g/mol, XLogP of 4.10, 4 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]phenyl]methanol is sourced from PubChem (CID 43229623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).