5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine

C10H13BrN2 — CID 61374335

IUPAC5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine
SMILESCC1CCN(c2ccc(Br)cn2)C1
InChIInChI=1S/C10H13BrN2/c1-8-4-5-13(7-8)10-3-2-9(11)6-12-10/h2-3,6,8H,4-5,7H2,1H3
InChIKeyXGIVZCMSZVSYNL-UHFFFAOYSA-N
MW241.13 g/mol
LogP2.69
Rot. Bonds1

About 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine

5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine (PubChem CID 61374335) has the molecular formula C10H13BrN2 and a molecular weight of 241.13 g/mol. Its IUPAC name is 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine.

Molecular Properties

Compound Name5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine
PubChem CID61374335
Molecular FormulaC10H13BrN2
Molecular Weight241.13 g/mol
Exact Mass240.03
IUPAC Name5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine
SMILESCC1CCN(c2ccc(Br)cn2)C1
InChIInChI=1S/C10H13BrN2/c1-8-4-5-13(7-8)10-3-2-9(11)6-12-10/h2-3,6,8H,4-5,7H2,1H3
InChIKeyXGIVZCMSZVSYNL-UHFFFAOYSA-N
XLogP2.69
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromo-2-pyridinyl)-4-methylazepane
CID 55249997
1-(5-bromo-2-pyridinyl)-N,N-dimethylpyrrolidin-3-amine;ethane
CID 143127002
3-(5-bromo-2-pyridinyl)-9-methyl-3,9-diazabicyclo[4.2.1]nonane
CID 79098403
[1-(5-bromo-2-pyridinyl)-4-methylpiperidin-3-yl]methanamine
CID 114961588
(3R)-1-(5-bromo-2-pyridinyl)-N,N-dicyclopropylpyrrolidin-3-amine
CID 66674145
2-[(3S)-3-methylpyrrolidin-1-yl]-5-propan-2-ylpyridine
CID 121288951
2-[(3R)-3-methylpyrrolidin-1-yl]-5-(trifluoromethyl)pyridine
CID 59059706
[(3S)-1-(5-bromo-2-pyridinyl)pyrrolidin-3-yl]methanol
CID 94407883
5-bromo-2-[(3S,4R)-3-imidazol-1-yl-4-methylpiperidin-1-yl]pyridine
CID 124741901
5-bromo-2-(4-ethoxypiperidin-1-yl)pyridine
CID 61374151
1-(5-bromo-2-pyridinyl)azocane
CID 55137358
N-[(3S,4R)-1-(5-bromo-2-pyridinyl)-3-fluoropiperidin-4-yl]acetamide
CID 146241785

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine?
The IUPAC name of 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine (CID 61374335) is 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine.
What is the SMILES notation for 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine?
The canonical SMILES for 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine is CC1CCN(c2ccc(Br)cn2)C1.
What is the InChIKey of 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine?
The InChIKey is XGIVZCMSZVSYNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2/c1-8-4-5-13(7-8)10-3-2-9(11)6-12-10/h2-3,6,8H,4-5,7H2,1H3.
What are the key properties of 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine?
5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine has a molecular weight of 241.13 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3-methylpyrrolidin-1-yl)pyridine is sourced from PubChem (CID 61374335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).