6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine

C11H11BrN2O — CID 54062323

IUPAC6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine
SMILESBrc1cnc2cc([C@@H]3CCCN3)oc2c1
InChIInChI=1S/C11H11BrN2O/c12-7-4-10-9(14-6-7)5-11(15-10)8-2-1-3-13-8/h4-6,8,13H,1-3H2/t8-/m0/s1
InChIKeyMAPCZMPKVLNLQH-QMMMGPOBSA-N
MW267.13 g/mol
LogP3.01
Rot. Bonds1

About 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine

6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine (PubChem CID 54062323) has the molecular formula C11H11BrN2O and a molecular weight of 267.13 g/mol. Its IUPAC name is 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine
PubChem CID54062323
Molecular FormulaC11H11BrN2O
Molecular Weight267.13 g/mol
Exact Mass266.01
IUPAC Name6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine
SMILESBrc1cnc2cc([C@@H]3CCCN3)oc2c1
InChIInChI=1S/C11H11BrN2O/c12-7-4-10-9(14-6-7)5-11(15-10)8-2-1-3-13-8/h4-6,8,13H,1-3H2/t8-/m0/s1
InChIKeyMAPCZMPKVLNLQH-QMMMGPOBSA-N
XLogP3.01
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-pyrrolidin-2-ylpyridine-3-carbaldehyde
CID 87941628
5-bromo-2-pyrrolidin-2-ylpyridine
CID 67294409
5-bromo-2-pyrrolidin-2-ylpyridine;hydrochloride
CID 118998863
3-bromo-5-pyrrolidin-2-ylpyridine;dihydrochloride
CID 155487206
5-bromo-3-chloro-2-[(2R)-piperidin-2-yl]pyridine
CID 130713607
5-bromo-N-(5-pyrrolidin-2-yl-1,3,4-oxadiazol-2-yl)pyridine-3-carboxamide
CID 102703521
5,6-dimethyl-2-pyrrolidin-2-yl-1,3-benzoxazole
CID 82230711
5-bromo-2-[(2S)-piperidin-2-yl]pyridine;hydrochloride
CID 171194911
3-bromo-5-piperidin-2-ylpyridine;dihydrochloride
CID 122198515
(2R)-2-(2,5-dibromophenyl)pyrrolidine
CID 131190573
(2S)-2-(2,4-dibromophenyl)pyrrolidine
CID 130706941
5-pyrrolidin-2-yl-1,2-oxazol-3-amine
CID 115094046

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine?
The IUPAC name of 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine (CID 54062323) is 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine.
What is the SMILES notation for 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine?
The canonical SMILES for 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine is Brc1cnc2cc([C@@H]3CCCN3)oc2c1.
What is the InChIKey of 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine?
The InChIKey is MAPCZMPKVLNLQH-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H11BrN2O/c12-7-4-10-9(14-6-7)5-11(15-10)8-2-1-3-13-8/h4-6,8,13H,1-3H2/t8-/m0/s1.
What are the key properties of 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine?
6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine has a molecular weight of 267.13 g/mol, XLogP of 3.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-[(2S)-pyrrolidin-2-yl]furo[3,2-b]pyridine is sourced from PubChem (CID 54062323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).