(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine

C11H16BrN3 — CID 171314087

IUPAC(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine
SMILESN[C@@H](c1cncc(Br)c1)C1CCNCC1
InChIInChI=1S/C11H16BrN3/c12-10-5-9(6-15-7-10)11(13)8-1-3-14-4-2-8/h5-8,11,14H,1-4,13H2/t11-/m1/s1
InChIKeyNDKPTYSVRVCJDE-LLVKDONJSA-N
MW270.17 g/mol
LogP1.84
Rot. Bonds2

About (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine

(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine (PubChem CID 171314087) has the molecular formula C11H16BrN3 and a molecular weight of 270.17 g/mol. Its IUPAC name is (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine.

Molecular Properties

Compound Name(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine
PubChem CID171314087
Molecular FormulaC11H16BrN3
Molecular Weight270.17 g/mol
Exact Mass269.05
IUPAC Name(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine
SMILESN[C@@H](c1cncc(Br)c1)C1CCNCC1
InChIInChI=1S/C11H16BrN3/c12-10-5-9(6-15-7-10)11(13)8-1-3-14-4-2-8/h5-8,11,14H,1-4,13H2/t11-/m1/s1
InChIKeyNDKPTYSVRVCJDE-LLVKDONJSA-N
XLogP1.84
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.17
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(R)-[3-bromo-5-(trifluoromethyl)phenyl]-piperidin-4-ylmethanamine
CID 171314429
(5-bromo-3-pyridinyl)-cyclopropylmethanol
CID 59825022
(5-bromo-3-pyridinyl)-cyclopropylmethanol;3,5-dibromopyridine
CID 160748574
(1R)-1-(5-bromo-3-pyridinyl)-2-cyclopropylethanamine;hydrochloride
CID 171198670
5-[amino(cyclopropyl)methyl]pyridin-3-amine
CID 55292052
(4-bromothiophen-2-yl)-piperidin-4-ylmethanamine
CID 82307070
1-[(S)-(5-bromo-3-pyridinyl)-cyclopentylmethyl]piperazine;dihydrochloride
CID 171272910
2-(5-bromo-3-pyridinyl)-1-piperidin-4-ylethanol
CID 104802357
(R)-(6-chloro-3-pyridinyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314290
(R)-(3,4-dichlorophenyl)-piperidin-4-ylmethanamine;hydrochloride
CID 171314201
1-(5-bromo-3-pyridinyl)ethanamine;dihydrochloride
CID 138110830
(3-bromo-4-methoxyphenyl)-piperidin-4-ylmethanamine
CID 82308332

Frequently Asked Questions

What is the IUPAC name of (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine?
The IUPAC name of (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine (CID 171314087) is (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine.
What is the SMILES notation for (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine?
The canonical SMILES for (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine is N[C@@H](c1cncc(Br)c1)C1CCNCC1.
What is the InChIKey of (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine?
The InChIKey is NDKPTYSVRVCJDE-LLVKDONJSA-N. The full InChI is InChI=1S/C11H16BrN3/c12-10-5-9(6-15-7-10)11(13)8-1-3-14-4-2-8/h5-8,11,14H,1-4,13H2/t11-/m1/s1.
What are the key properties of (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine?
(R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine has a molecular weight of 270.17 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(5-bromo-3-pyridinyl)-piperidin-4-ylmethanamine is sourced from PubChem (CID 171314087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).