5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine

C11H16BrN3 — CID 61228660

IUPAC5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine
SMILESCC1CCCN(c2ncc(Br)cc2N)C1
InChIInChI=1S/C11H16BrN3/c1-8-3-2-4-15(7-8)11-10(13)5-9(12)6-14-11/h5-6,8H,2-4,7,13H2,1H3
InChIKeySTGOWSUAIMYQBA-UHFFFAOYSA-N
MW270.17 g/mol
LogP2.66
Rot. Bonds1

About 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine

5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine (PubChem CID 61228660) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine
PubChem CID61228660
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine
SMILESCC1CCCN(c2ncc(Br)cc2N)C1
InChIInChI=1S/C11H16BrN3/c1-8-3-2-4-15(7-8)11-10(13)5-9(12)6-14-11/h5-6,8H,2-4,7,13H2,1H3
InChIKeySTGOWSUAIMYQBA-UHFFFAOYSA-N
XLogP2.66
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine?
The IUPAC name of 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine (CID 61228660) is 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine.
What is the SMILES notation for 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine?
The canonical SMILES for 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine is CC1CCCN(c2ncc(Br)cc2N)C1.
What is the InChIKey of 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine?
The InChIKey is STGOWSUAIMYQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrN3/c1-8-3-2-4-15(7-8)11-10(13)5-9(12)6-14-11/h5-6,8H,2-4,7,13H2,1H3.
What are the key properties of 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine?
5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine has a molecular weight of 270.17 g/mol, XLogP of 2.66, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3-methylpiperidin-1-yl)pyridin-3-amine is sourced from PubChem (CID 61228660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).