5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane

C11H20BrN3O — CID 143903964

IUPAC5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane
SMILESCC.CN(C)CCOc1ncc(N)cc1Br
InChIInChI=1S/C9H14BrN3O.C2H6/c1-13(2)3-4-14-9-8(10)5-7(11)6-12-9;1-2/h5-6H,3-4,11H2,1-2H3;1-2H3
InChIKeyIZCVOGPMCDZCNG-UHFFFAOYSA-N
MW290.20 g/mol
LogP2.39
Rot. Bonds4

About 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane

5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane (PubChem CID 143903964) has the molecular formula C11H20BrN3O and a molecular weight of 290.20 g/mol. Its IUPAC name is 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane.

Molecular Properties

Compound Name5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane
PubChem CID143903964
Molecular FormulaC11H20BrN3O
Molecular Weight290.20 g/mol
Exact Mass289.08
IUPAC Name5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane
SMILESCC.CN(C)CCOc1ncc(N)cc1Br
InChIInChI=1S/C9H14BrN3O.C2H6/c1-13(2)3-4-14-9-8(10)5-7(11)6-12-9;1-2/h5-6H,3-4,11H2,1-2H3;1-2H3
InChIKeyIZCVOGPMCDZCNG-UHFFFAOYSA-N
XLogP2.39
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.20
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-6-heptoxypyridin-3-amine
CID 79535566
5-bromo-6-(2-ethoxyethoxy)pyridin-3-amine
CID 79534577
6-[2-(dimethylamino)ethoxy]-5-(trifluoromethyl)pyridin-3-amine
CID 90415876
5-bromo-6-(3-methoxy-3-methylbutoxy)pyridin-3-amine
CID 106664894
3-[(3-bromo-5-chloro-2-pyridinyl)oxy]-N,N-dimethylpropan-1-amine
CID 114837675
3-bromo-2-N-[2-(dimethylamino)ethyl]pyridine-2,5-diamine
CID 79021090
6-[2-(diethylamino)ethoxy]-5-methylpyridin-3-amine
CID 62477090
5-bromo-4-[2-(dimethylamino)ethoxy]pyridin-3-amine
CID 103518771
5-[2-(dimethylamino)ethoxy]benzene-1,3-diamine
CID 68840526
5-bromo-6-[(4-chlorophenyl)methoxy]pyridin-3-amine
CID 79534403
5-bromo-6-(3,5-dimethylcyclohexyl)oxypyridin-3-amine
CID 79535668
3-bromo-2-N,2-N-bis(2-ethoxyethyl)pyridine-2,5-diamine
CID 82965351

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane?
The IUPAC name of 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane (CID 143903964) is 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane.
What is the SMILES notation for 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane?
The canonical SMILES for 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane is CC.CN(C)CCOc1ncc(N)cc1Br.
What is the InChIKey of 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane?
The InChIKey is IZCVOGPMCDZCNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14BrN3O.C2H6/c1-13(2)3-4-14-9-8(10)5-7(11)6-12-9;1-2/h5-6H,3-4,11H2,1-2H3;1-2H3.
What are the key properties of 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane?
5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane has a molecular weight of 290.20 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-[2-(dimethylamino)ethoxy]pyridin-3-amine;ethane is sourced from PubChem (CID 143903964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).