6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine

C14H14Cl2N2O — CID 79239120

IUPAC6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(COc2ccc(Cl)c(Cl)c2)n1
InChIInChI=1S/C14H14Cl2N2O/c1-2-17-14-5-3-4-10(18-14)9-19-11-6-7-12(15)13(16)8-11/h3-8H,2,9H2,1H3,(H,17,18)
InChIKeySEIZVJAOGAHDSW-UHFFFAOYSA-N
MW297.19 g/mol
LogP4.40
Rot. Bonds5

About 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine

6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine (PubChem CID 79239120) has the molecular formula C14H14Cl2N2O and a molecular weight of 297.19 g/mol. Its IUPAC name is 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine
PubChem CID79239120
Molecular FormulaC14H14Cl2N2O
Molecular Weight297.19 g/mol
Exact Mass296.05
IUPAC Name6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(COc2ccc(Cl)c(Cl)c2)n1
InChIInChI=1S/C14H14Cl2N2O/c1-2-17-14-5-3-4-10(18-14)9-19-11-6-7-12(15)13(16)8-11/h3-8H,2,9H2,1H3,(H,17,18)
InChIKeySEIZVJAOGAHDSW-UHFFFAOYSA-N
XLogP4.40
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.19
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-6-(naphthalen-2-yloxymethyl)pyridin-2-amine
CID 79231800
6-[(4-tert-butylphenoxy)methyl]-N-ethylpyridin-2-amine
CID 79231253
N-ethyl-6-[(3-ethylphenoxy)methyl]pyridin-2-amine
CID 79239613
N-ethyl-6-[(4-propoxyphenoxy)methyl]pyridin-2-amine
CID 79232344
6-(3,4-dichlorophenoxy)-N-ethylpyridin-2-amine
CID 80874477
N-ethyl-6-[(4-methylsulfonylphenoxy)methyl]pyridin-2-amine
CID 79232071
N-[[6-[(3,4-dichlorophenoxy)methyl]-2-pyridinyl]methyl]propan-1-amine
CID 106908243
6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine
CID 79239525
6-[(2-chloro-4-nitrophenoxy)methyl]-N-ethylpyridin-2-amine
CID 79233930
6-[(4-chloro-2-nitrophenoxy)methyl]-N-ethylpyridin-2-amine
CID 79231263
[6-[(4-chloro-3-ethylphenoxy)methyl]-2-pyridinyl]methanamine
CID 106908219
2-[(3,4-dichlorophenoxy)methyl]pyridine
CID 174779615

Frequently Asked Questions

What is the IUPAC name of 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine (CID 79239120) is 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine is CCNc1cccc(COc2ccc(Cl)c(Cl)c2)n1.
What is the InChIKey of 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine?
The InChIKey is SEIZVJAOGAHDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2N2O/c1-2-17-14-5-3-4-10(18-14)9-19-11-6-7-12(15)13(16)8-11/h3-8H,2,9H2,1H3,(H,17,18).
What are the key properties of 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine?
6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine has a molecular weight of 297.19 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3,4-dichlorophenoxy)methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 79239120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).