[2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine

C15H15Cl2NO2 — CID 60878519

IUPAC[2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine
SMILESCOc1ccc(OCc2ccc(Cl)cc2Cl)c(CN)c1
InChIInChI=1S/C15H15Cl2NO2/c1-19-13-4-5-15(11(6-13)8-18)20-9-10-2-3-12(16)7-14(10)17/h2-7H,8-9,18H2,1H3
InChIKeyXVWGEXZZLANUNE-UHFFFAOYSA-N
MW312.20 g/mol
LogP4.04
Rot. Bonds5

About [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine

[2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine (PubChem CID 60878519) has the molecular formula C15H15Cl2NO2 and a molecular weight of 312.20 g/mol. Its IUPAC name is [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine.

Molecular Properties

Compound Name[2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine
PubChem CID60878519
Molecular FormulaC15H15Cl2NO2
Molecular Weight312.20 g/mol
Exact Mass311.05
IUPAC Name[2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine
SMILESCOc1ccc(OCc2ccc(Cl)cc2Cl)c(CN)c1
InChIInChI=1S/C15H15Cl2NO2/c1-19-13-4-5-15(11(6-13)8-18)20-9-10-2-3-12(16)7-14(10)17/h2-7H,8-9,18H2,1H3
InChIKeyXVWGEXZZLANUNE-UHFFFAOYSA-N
XLogP4.04
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.20
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2,4-dichlorophenyl)methoxy]-5-methylphenyl]methanamine
CID 63322638
[2-[(4-chloro-3-fluorophenyl)methoxy]-5-methoxyphenyl]methanamine
CID 107878670
1-[2-[(2,4-dichlorophenyl)methoxy]-4-methoxyphenyl]ethanone
CID 78906437
2-(bromomethyl)-1-[(2,5-dichlorophenyl)methoxy]-4-methoxybenzene
CID 65317020
(2-chloro-4-methoxyphenyl)methanamine
CID 22467642
(1R)-1-[2-[(2,4-dichlorophenyl)methoxy]-4-methoxyphenyl]ethanol
CID 82002286
[2-[(5-chlorothiophen-2-yl)methoxy]-5-methoxyphenyl]methanamine
CID 60878324
[2-[(2,5-dimethylphenyl)methoxy]-5-methoxyphenyl]methanamine
CID 61481790
[5-methoxy-2-(pyrimidin-2-ylmethoxy)phenyl]methanamine
CID 62697998
1,4-dichloro-2-[(2-fluoro-4-methoxyphenyl)methoxy]benzene
CID 102879421
2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene
CID 43268073
3-[(2,4-dichlorophenyl)methoxy]-4-methoxybenzenecarbothioamide
CID 20991411

Frequently Asked Questions

What is the IUPAC name of [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine?
The IUPAC name of [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine (CID 60878519) is [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine.
What is the SMILES notation for [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine?
The canonical SMILES for [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine is COc1ccc(OCc2ccc(Cl)cc2Cl)c(CN)c1.
What is the InChIKey of [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine?
The InChIKey is XVWGEXZZLANUNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO2/c1-19-13-4-5-15(11(6-13)8-18)20-9-10-2-3-12(16)7-14(10)17/h2-7H,8-9,18H2,1H3.
What are the key properties of [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine?
[2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine has a molecular weight of 312.20 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2,4-dichlorophenyl)methoxy]-5-methoxyphenyl]methanamine is sourced from PubChem (CID 60878519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).