6-ethoxy-1-propan-2-yl-2H-pyridine

C10H17NO — CID 69103294

IUPAC6-ethoxy-1-propan-2-yl-2H-pyridine
SMILESCCOC1=CC=CCN1C(C)C
InChIInChI=1S/C10H17NO/c1-4-12-10-7-5-6-8-11(10)9(2)3/h5-7,9H,4,8H2,1-3H3
InChIKeyIUYJHQMMCWSIMY-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.14
Rot. Bonds3

About 6-ethoxy-1-propan-2-yl-2H-pyridine

6-ethoxy-1-propan-2-yl-2H-pyridine (PubChem CID 69103294) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 6-ethoxy-1-propan-2-yl-2H-pyridine.

Molecular Properties

Compound Name6-ethoxy-1-propan-2-yl-2H-pyridine
PubChem CID69103294
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name6-ethoxy-1-propan-2-yl-2H-pyridine
SMILESCCOC1=CC=CCN1C(C)C
InChIInChI=1S/C10H17NO/c1-4-12-10-7-5-6-8-11(10)9(2)3/h5-7,9H,4,8H2,1-3H3
InChIKeyIUYJHQMMCWSIMY-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-1-propan-2-yl-2H-pyridine?
The IUPAC name of 6-ethoxy-1-propan-2-yl-2H-pyridine (CID 69103294) is 6-ethoxy-1-propan-2-yl-2H-pyridine.
What is the SMILES notation for 6-ethoxy-1-propan-2-yl-2H-pyridine?
The canonical SMILES for 6-ethoxy-1-propan-2-yl-2H-pyridine is CCOC1=CC=CCN1C(C)C.
What is the InChIKey of 6-ethoxy-1-propan-2-yl-2H-pyridine?
The InChIKey is IUYJHQMMCWSIMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-4-12-10-7-5-6-8-11(10)9(2)3/h5-7,9H,4,8H2,1-3H3.
What are the key properties of 6-ethoxy-1-propan-2-yl-2H-pyridine?
6-ethoxy-1-propan-2-yl-2H-pyridine has a molecular weight of 167.25 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-1-propan-2-yl-2H-pyridine is sourced from PubChem (CID 69103294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).