1-(5-bromo-3-pyridinyl)piperidin-4-amine

C10H14BrN3 — CID 70343493

IUPAC1-(5-bromo-3-pyridinyl)piperidin-4-amine
SMILESNC1CCN(c2cncc(Br)c2)CC1
InChIInChI=1S/C10H14BrN3/c11-8-5-10(7-13-6-8)14-3-1-9(12)2-4-14/h5-7,9H,1-4,12H2
InChIKeyZNZAUHLJQPGUHQ-UHFFFAOYSA-N
MW256.15 g/mol
LogP1.77
Rot. Bonds1

About 1-(5-bromo-3-pyridinyl)piperidin-4-amine

1-(5-bromo-3-pyridinyl)piperidin-4-amine (PubChem CID 70343493) has the molecular formula C10H14BrN3 and a molecular weight of 256.15 g/mol. Its IUPAC name is 1-(5-bromo-3-pyridinyl)piperidin-4-amine.

Molecular Properties

Compound Name1-(5-bromo-3-pyridinyl)piperidin-4-amine
PubChem CID70343493
Molecular FormulaC10H14BrN3
Molecular Weight256.15 g/mol
Exact Mass255.04
IUPAC Name1-(5-bromo-3-pyridinyl)piperidin-4-amine
SMILESNC1CCN(c2cncc(Br)c2)CC1
InChIInChI=1S/C10H14BrN3/c11-8-5-10(7-13-6-8)14-3-1-9(12)2-4-14/h5-7,9H,1-4,12H2
InChIKeyZNZAUHLJQPGUHQ-UHFFFAOYSA-N
XLogP1.77
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.15
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-3-pyridinyl)piperidin-4-amine?
The IUPAC name of 1-(5-bromo-3-pyridinyl)piperidin-4-amine (CID 70343493) is 1-(5-bromo-3-pyridinyl)piperidin-4-amine.
What is the SMILES notation for 1-(5-bromo-3-pyridinyl)piperidin-4-amine?
The canonical SMILES for 1-(5-bromo-3-pyridinyl)piperidin-4-amine is NC1CCN(c2cncc(Br)c2)CC1.
What is the InChIKey of 1-(5-bromo-3-pyridinyl)piperidin-4-amine?
The InChIKey is ZNZAUHLJQPGUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrN3/c11-8-5-10(7-13-6-8)14-3-1-9(12)2-4-14/h5-7,9H,1-4,12H2.
What are the key properties of 1-(5-bromo-3-pyridinyl)piperidin-4-amine?
1-(5-bromo-3-pyridinyl)piperidin-4-amine has a molecular weight of 256.15 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-3-pyridinyl)piperidin-4-amine is sourced from PubChem (CID 70343493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).