6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine

C17H15BrN2O — CID 80865759

IUPAC6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Oc2ccc3cc(Br)ccc3c2)n1
InChIInChI=1S/C17H15BrN2O/c1-2-19-16-4-3-5-17(20-16)21-15-9-7-12-10-14(18)8-6-13(12)11-15/h3-11H,2H2,1H3,(H,19,20)
InChIKeyNKPZJNAFLQTVSZ-UHFFFAOYSA-N
MW343.22 g/mol
LogP5.22
Rot. Bonds4

About 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine

6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine (PubChem CID 80865759) has the molecular formula C17H15BrN2O and a molecular weight of 343.22 g/mol. Its IUPAC name is 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine
PubChem CID80865759
Molecular FormulaC17H15BrN2O
Molecular Weight343.22 g/mol
Exact Mass342.04
IUPAC Name6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Oc2ccc3cc(Br)ccc3c2)n1
InChIInChI=1S/C17H15BrN2O/c1-2-19-16-4-3-5-17(20-16)21-15-9-7-12-10-14(18)8-6-13(12)11-15/h3-11H,2H2,1H3,(H,19,20)
InChIKeyNKPZJNAFLQTVSZ-UHFFFAOYSA-N
XLogP5.22
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.22
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3-bromophenoxy)-N-ethylpyridin-2-amine
CID 80869088
6-(3,4-dichlorophenoxy)-N-ethylpyridin-2-amine
CID 80874477
6-(4-bromo-3,5-dimethylphenoxy)-N-ethylpyridin-2-amine
CID 107727278
6-(4-bromo-2-fluorophenoxy)-N-ethylpyridin-2-amine
CID 80881020
6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine
CID 80873339
N-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyridin-2-amine
CID 80872364
N-ethyl-6-(3-propan-2-ylphenoxy)pyridin-2-amine
CID 80864399
6-(4-butan-2-ylphenoxy)-N-ethylpyridin-2-amine
CID 107669557
6-(3-bromophenoxy)-2-tert-butyl-N-ethylpyrimidin-4-amine
CID 80966382
6-[[6-(ethylamino)-2-pyridinyl]oxy]-3,4-dihydro-1H-quinolin-2-one
CID 80865656
6-(3-bromo-5-fluorophenoxy)-N-propylpyridin-2-amine
CID 81325494
6-(4-bromo-2-fluorophenoxy)-N-propylpyridin-2-amine
CID 80881519

Frequently Asked Questions

What is the IUPAC name of 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine?
The IUPAC name of 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine (CID 80865759) is 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine is CCNc1cccc(Oc2ccc3cc(Br)ccc3c2)n1.
What is the InChIKey of 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine?
The InChIKey is NKPZJNAFLQTVSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15BrN2O/c1-2-19-16-4-3-5-17(20-16)21-15-9-7-12-10-14(18)8-6-13(12)11-15/h3-11H,2H2,1H3,(H,19,20).
What are the key properties of 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine?
6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine has a molecular weight of 343.22 g/mol, XLogP of 5.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-bromonaphthalen-2-yl)oxy-N-ethylpyridin-2-amine is sourced from PubChem (CID 80865759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).