1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine

C11H15F2NO — CID 62801049

IUPAC1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine
SMILESCCNC(COC)c1ccc(F)cc1F
InChIInChI=1S/C11H15F2NO/c1-3-14-11(7-15-2)9-5-4-8(12)6-10(9)13/h4-6,11,14H,3,7H2,1-2H3
InChIKeyXNILYYNPJUSSLP-UHFFFAOYSA-N
MW215.24 g/mol
LogP2.26
Rot. Bonds5

About 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine

1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine (PubChem CID 62801049) has the molecular formula C11H15F2NO and a molecular weight of 215.24 g/mol. Its IUPAC name is 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine.

Molecular Properties

Compound Name1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine
PubChem CID62801049
Molecular FormulaC11H15F2NO
Molecular Weight215.24 g/mol
Exact Mass215.11
IUPAC Name1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine
SMILESCCNC(COC)c1ccc(F)cc1F
InChIInChI=1S/C11H15F2NO/c1-3-14-11(7-15-2)9-5-4-8(12)6-10(9)13/h4-6,11,14H,3,7H2,1-2H3
InChIKeyXNILYYNPJUSSLP-UHFFFAOYSA-N
XLogP2.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.24
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 3-(2,4-difluorophenyl)-3-(ethylamino)propanoate
CID 65234652
1,2-bis(2,4-difluorophenyl)-N-ethylethanamine
CID 63084221
1-(2,4-difluorophenyl)-N-ethyl-N',N'-dimethylethane-1,2-diamine
CID 79093891
1-(2,4-difluorophenyl)-N-ethyl-2-(4-methoxyphenyl)ethanamine
CID 43491085
1-(2,4-difluorophenyl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105143692
1-(2,4-difluorophenyl)-N-ethylheptan-1-amine
CID 55185685
1-(2,4-dichlorophenyl)-N-ethyl-2-methoxyethanamine
CID 105008882
1-(2,4-difluorophenyl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62539902
1-(2,4-difluorophenyl)-N,N',N'-triethylpropane-1,3-diamine
CID 79087248
2-(2-bromo-5-fluorophenyl)-1-(2,4-difluorophenyl)-N-ethylethanamine
CID 63418093
1-(2,5-difluorophenyl)-N-ethyl-2-propan-2-yloxyethanamine
CID 79575096
1-(4-chloro-2-fluorophenyl)-N-ethyl-4-methoxybutan-1-amine
CID 78924376

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine?
The IUPAC name of 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine (CID 62801049) is 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine.
What is the SMILES notation for 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine?
The canonical SMILES for 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine is CCNC(COC)c1ccc(F)cc1F.
What is the InChIKey of 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine?
The InChIKey is XNILYYNPJUSSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NO/c1-3-14-11(7-15-2)9-5-4-8(12)6-10(9)13/h4-6,11,14H,3,7H2,1-2H3.
What are the key properties of 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine?
1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine has a molecular weight of 215.24 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-difluorophenyl)-N-ethyl-2-methoxyethanamine is sourced from PubChem (CID 62801049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).