2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine

C21H21NO3 — CID 10065530

IUPAC2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine
SMILESCOc1ccc(-c2ccc(-c3ccccn3)o2)cc1OC1CCCC1
InChIInChI=1S/C21H21NO3/c1-23-20-10-9-15(14-21(20)24-16-6-2-3-7-16)18-11-12-19(25-18)17-8-4-5-13-22-17/h4-5,8-14,16H,2-3,6-7H2,1H3
InChIKeyXWVSZQHLLOXQKA-UHFFFAOYSA-N
MW335.40 g/mol
LogP5.34
Rot. Bonds5

About 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine

2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine (PubChem CID 10065530) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine.

Molecular Properties

Compound Name2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine
PubChem CID10065530
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC Name2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine
SMILESCOc1ccc(-c2ccc(-c3ccccn3)o2)cc1OC1CCCC1
InChIInChI=1S/C21H21NO3/c1-23-20-10-9-15(14-21(20)24-16-6-2-3-7-16)18-11-12-19(25-18)17-8-4-5-13-22-17/h4-5,8-14,16H,2-3,6-7H2,1H3
InChIKeyXWVSZQHLLOXQKA-UHFFFAOYSA-N
XLogP5.34
TPSA44.49 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.40
LogP ≤ 55.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Papaveraldine
CID 96932
5-[(2-methoxy-4-propylphenoxy)methyl]-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 1091781
[2-(3-Cyclopentyloxy-4-methoxy-phenyl)-5-pyridin-2-yl-furan-3-yl]-phenyl-methanone
CID 19361675
4-[5-(3-Cyclopentyloxy-4-methoxy-phenyl)-furan-2-yl]-pyridine
CID 20583506
3-[5-(3-Cyclopentyloxy-4-methoxy-phenyl)-furan-2-yl]-pyridine
CID 44339585
2-[5-(3-Cyclopentyloxy-4-methoxy-phenyl)-furan-2-yl]-quinoline
CID 44339619
2-[4-Benzenesulfonyl-5-(3-cyclopentyloxy-4-methoxy-phenyl)-furan-2-yl]-pyridine
CID 44339632
2-[3-Benzenesulfonyl-5-(3-cyclopentyloxy-4-methoxy-phenyl)-furan-2-yl]-pyridine
CID 44339676
6,7-Dimethoxy-2-((7-methoxy-2-(pyridin-2-yl)benzofuran-4-yl)methyl)-1,2,3,4-tetrahydroisoquinoline
CID 44438148
(7-Methoxy-2-methylindolizin-3-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 52951491
1-[2-(4-allyl-2-methoxyphenoxy)ethyl]-1H-pyrrole-2-carbaldehyde
CID 974671
2-Phenyl-3-(3,4,5-trimethoxybenzoyl)indolizine
CID 2359773

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine?
The IUPAC name of 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine (CID 10065530) is 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine.
What is the SMILES notation for 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine?
The canonical SMILES for 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine is COc1ccc(-c2ccc(-c3ccccn3)o2)cc1OC1CCCC1.
What is the InChIKey of 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine?
The InChIKey is XWVSZQHLLOXQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21NO3/c1-23-20-10-9-15(14-21(20)24-16-6-2-3-7-16)18-11-12-19(25-18)17-8-4-5-13-22-17/h4-5,8-14,16H,2-3,6-7H2,1H3.
What are the key properties of 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine?
2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine has a molecular weight of 335.40 g/mol, XLogP of 5.34, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-cyclopentyloxy-4-methoxyphenyl)furan-2-yl]pyridine is sourced from PubChem (CID 10065530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).