2-ethyl-3-(furan-2-ylmethyl)pyridine

C12H13NO — CID 173468661

IUPAC2-ethyl-3-(furan-2-ylmethyl)pyridine
SMILESCCc1ncccc1Cc1ccco1
InChIInChI=1S/C12H13NO/c1-2-12-10(5-3-7-13-12)9-11-6-4-8-14-11/h3-8H,2,9H2,1H3
InChIKeyBRYJQXLAEJOYJF-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.83
Rot. Bonds3

About 2-ethyl-3-(furan-2-ylmethyl)pyridine

2-ethyl-3-(furan-2-ylmethyl)pyridine (PubChem CID 173468661) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-ethyl-3-(furan-2-ylmethyl)pyridine.

Molecular Properties

Compound Name2-ethyl-3-(furan-2-ylmethyl)pyridine
PubChem CID173468661
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name2-ethyl-3-(furan-2-ylmethyl)pyridine
SMILESCCc1ncccc1Cc1ccco1
InChIInChI=1S/C12H13NO/c1-2-12-10(5-3-7-13-12)9-11-6-4-8-14-11/h3-8H,2,9H2,1H3
InChIKeyBRYJQXLAEJOYJF-UHFFFAOYSA-N
XLogP2.83
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(furan-2-ylmethyl)pyridine?
The IUPAC name of 2-ethyl-3-(furan-2-ylmethyl)pyridine (CID 173468661) is 2-ethyl-3-(furan-2-ylmethyl)pyridine.
What is the SMILES notation for 2-ethyl-3-(furan-2-ylmethyl)pyridine?
The canonical SMILES for 2-ethyl-3-(furan-2-ylmethyl)pyridine is CCc1ncccc1Cc1ccco1.
What is the InChIKey of 2-ethyl-3-(furan-2-ylmethyl)pyridine?
The InChIKey is BRYJQXLAEJOYJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-2-12-10(5-3-7-13-12)9-11-6-4-8-14-11/h3-8H,2,9H2,1H3.
What are the key properties of 2-ethyl-3-(furan-2-ylmethyl)pyridine?
2-ethyl-3-(furan-2-ylmethyl)pyridine has a molecular weight of 187.24 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(furan-2-ylmethyl)pyridine is sourced from PubChem (CID 173468661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).