5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine

C14H14Br2N2O — CID 64719771

IUPAC5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(COc2ccc(Br)cc2Br)cn1
InChIInChI=1S/C14H14Br2N2O/c1-2-17-14-6-3-10(8-18-14)9-19-13-5-4-11(15)7-12(13)16/h3-8H,2,9H2,1H3,(H,17,18)
InChIKeyDBTAMKPOQFALPP-UHFFFAOYSA-N
MW386.09 g/mol
LogP4.62
Rot. Bonds5

About 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine

5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine (PubChem CID 64719771) has the molecular formula C14H14Br2N2O and a molecular weight of 386.09 g/mol. Its IUPAC name is 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine
PubChem CID64719771
Molecular FormulaC14H14Br2N2O
Molecular Weight386.09 g/mol
Exact Mass383.95
IUPAC Name5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(COc2ccc(Br)cc2Br)cn1
InChIInChI=1S/C14H14Br2N2O/c1-2-17-14-6-3-10(8-18-14)9-19-13-5-4-11(15)7-12(13)16/h3-8H,2,9H2,1H3,(H,17,18)
InChIKeyDBTAMKPOQFALPP-UHFFFAOYSA-N
XLogP4.62
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.09
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(2-bromophenoxy)methyl]-N-ethylpyridin-2-amine
CID 62194637
[4-[[6-(ethylamino)-3-pyridinyl]methoxy]-3-methoxyphenyl]methanol
CID 107744742
5-[(4-bromo-3,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine
CID 107725734
5-[(3-bromo-4-fluorophenoxy)methyl]-N-ethylpyridin-2-amine
CID 83235069
N-ethyl-5-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 62194827
N-ethyl-5-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62194578
5-[(2,4-dibromophenoxy)methyl]-N-ethyl-1,3-thiazol-2-amine
CID 79774037
[4-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
CID 55044751
N-ethyl-5-[(4-ethylphenoxy)methyl]pyridin-2-amine
CID 55044783
[5-[(2-bromo-4-chlorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 62246224
N-ethyl-5-[(4-propylphenoxy)methyl]pyridin-2-amine
CID 62548057
[3-[[6-(ethylamino)-3-pyridinyl]methoxy]phenyl]methanol
CID 62189596

Frequently Asked Questions

What is the IUPAC name of 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine (CID 64719771) is 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine is CCNc1ccc(COc2ccc(Br)cc2Br)cn1.
What is the InChIKey of 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine?
The InChIKey is DBTAMKPOQFALPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Br2N2O/c1-2-17-14-6-3-10(8-18-14)9-19-13-5-4-11(15)7-12(13)16/h3-8H,2,9H2,1H3,(H,17,18).
What are the key properties of 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine?
5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine has a molecular weight of 386.09 g/mol, XLogP of 4.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,4-dibromophenoxy)methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 64719771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).