3-ethyl-5-(2-methoxypropan-2-yl)pyridine

C11H17NO — CID 121401168

IUPAC3-ethyl-5-(2-methoxypropan-2-yl)pyridine
SMILESCCc1cncc(C(C)(C)OC)c1
InChIInChI=1S/C11H17NO/c1-5-9-6-10(8-12-7-9)11(2,3)13-4/h6-8H,5H2,1-4H3
InChIKeyNEDFHTDRFMBWAX-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.53
Rot. Bonds3

About 3-ethyl-5-(2-methoxypropan-2-yl)pyridine

3-ethyl-5-(2-methoxypropan-2-yl)pyridine (PubChem CID 121401168) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 3-ethyl-5-(2-methoxypropan-2-yl)pyridine.

Molecular Properties

Compound Name3-ethyl-5-(2-methoxypropan-2-yl)pyridine
PubChem CID121401168
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name3-ethyl-5-(2-methoxypropan-2-yl)pyridine
SMILESCCc1cncc(C(C)(C)OC)c1
InChIInChI=1S/C11H17NO/c1-5-9-6-10(8-12-7-9)11(2,3)13-4/h6-8H,5H2,1-4H3
InChIKeyNEDFHTDRFMBWAX-UHFFFAOYSA-N
XLogP2.53
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(2-methoxypropan-2-yl)pyridine?
The IUPAC name of 3-ethyl-5-(2-methoxypropan-2-yl)pyridine (CID 121401168) is 3-ethyl-5-(2-methoxypropan-2-yl)pyridine.
What is the SMILES notation for 3-ethyl-5-(2-methoxypropan-2-yl)pyridine?
The canonical SMILES for 3-ethyl-5-(2-methoxypropan-2-yl)pyridine is CCc1cncc(C(C)(C)OC)c1.
What is the InChIKey of 3-ethyl-5-(2-methoxypropan-2-yl)pyridine?
The InChIKey is NEDFHTDRFMBWAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-5-9-6-10(8-12-7-9)11(2,3)13-4/h6-8H,5H2,1-4H3.
What are the key properties of 3-ethyl-5-(2-methoxypropan-2-yl)pyridine?
3-ethyl-5-(2-methoxypropan-2-yl)pyridine has a molecular weight of 179.26 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(2-methoxypropan-2-yl)pyridine is sourced from PubChem (CID 121401168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).