2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine

C14H15ClN2O — CID 77080675

IUPAC2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine
SMILESClc1ccc(CN2CCCC2c2ccccn2)o1
InChIInChI=1S/C14H15ClN2O/c15-14-7-6-11(18-14)10-17-9-3-5-13(17)12-4-1-2-8-16-12/h1-2,4,6-8,13H,3,5,9-10H2
InChIKeyCWUOZJVBNQFPDB-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.67
Rot. Bonds3

About 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine

2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine (PubChem CID 77080675) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine.

Molecular Properties

Compound Name2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine
PubChem CID77080675
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine
SMILESClc1ccc(CN2CCCC2c2ccccn2)o1
InChIInChI=1S/C14H15ClN2O/c15-14-7-6-11(18-14)10-17-9-3-5-13(17)12-4-1-2-8-16-12/h1-2,4,6-8,13H,3,5,9-10H2
InChIKeyCWUOZJVBNQFPDB-UHFFFAOYSA-N
XLogP3.67
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-[[(2R)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]furan-2-yl]benzonitrile
CID 95729395
3-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]-5-methyl-1H-1,2,4-triazole
CID 77098303
2-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95841459
2-pyridin-2-yl-5-[(2-pyridin-2-ylpyrrolidin-1-yl)methyl]pyrimidine
CID 56714022
4-[[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]-1,3-thiazole
CID 95729061
2-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]pyridine
CID 99937922
2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid
CID 131863720
2-[[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]benzoic acid
CID 95200148
5-[[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]methyl]-2-pyrrolidin-1-ylpyrimidine
CID 95219231
2-[(2R)-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95730792
2-[(2-pyridin-2-ylpiperidin-1-yl)methyl]-1,3-thiazole
CID 77081994
2-[(2R)-1-[(3-pyridin-2-ylphenyl)methyl]pyrrolidin-2-yl]pyridine
CID 95714571

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine?
The IUPAC name of 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine (CID 77080675) is 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine.
What is the SMILES notation for 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine?
The canonical SMILES for 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine is Clc1ccc(CN2CCCC2c2ccccn2)o1.
What is the InChIKey of 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine?
The InChIKey is CWUOZJVBNQFPDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c15-14-7-6-11(18-14)10-17-9-3-5-13(17)12-4-1-2-8-16-12/h1-2,4,6-8,13H,3,5,9-10H2.
What are the key properties of 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine?
2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine has a molecular weight of 262.74 g/mol, XLogP of 3.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(5-chlorofuran-2-yl)methyl]pyrrolidin-2-yl]pyridine is sourced from PubChem (CID 77080675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).