3-(difluoromethoxy)-5-pentan-2-ylpyridine

C11H15F2NO — CID 166854522

IUPAC3-(difluoromethoxy)-5-pentan-2-ylpyridine
SMILESCCCC(C)c1cncc(OC(F)F)c1
InChIInChI=1S/C11H15F2NO/c1-3-4-8(2)9-5-10(7-14-6-9)15-11(12)13/h5-8,11H,3-4H2,1-2H3
InChIKeyDMPZEWYQEXWSKQ-UHFFFAOYSA-N
MW215.24 g/mol
LogP3.59
Rot. Bonds5

About 3-(difluoromethoxy)-5-pentan-2-ylpyridine

3-(difluoromethoxy)-5-pentan-2-ylpyridine (PubChem CID 166854522) has the molecular formula C11H15F2NO and a molecular weight of 215.24 g/mol. Its IUPAC name is 3-(difluoromethoxy)-5-pentan-2-ylpyridine.

Molecular Properties

Compound Name3-(difluoromethoxy)-5-pentan-2-ylpyridine
PubChem CID166854522
Molecular FormulaC11H15F2NO
Molecular Weight215.24 g/mol
Exact Mass215.11
IUPAC Name3-(difluoromethoxy)-5-pentan-2-ylpyridine
SMILESCCCC(C)c1cncc(OC(F)F)c1
InChIInChI=1S/C11H15F2NO/c1-3-4-8(2)9-5-10(7-14-6-9)15-11(12)13/h5-8,11H,3-4H2,1-2H3
InChIKeyDMPZEWYQEXWSKQ-UHFFFAOYSA-N
XLogP3.59
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.24
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-pentan-2-yl-5-phenylmethoxypyridine
CID 166644961
2-methoxy-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
CID 116718601
3-(difluoromethyl)-5-hexan-2-ylpyridine
CID 156508681
5-(difluoromethoxy)pyridine-3-carbonitrile
CID 46311553
5-pentan-2-yloxypyridine-3-carboxylic acid
CID 107890063
2-ethoxy-N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)pentan-1-amine
CID 116718083
N-[2-methylsulfonyl-1-(5-propan-2-yloxy-3-pyridinyl)ethyl]propan-1-amine
CID 105027295
N-ethyl-1-(5-propan-2-yloxy-3-pyridinyl)hexan-1-amine
CID 105027344
3-(2,2-difluoroethoxy)-1-(5-propan-2-yloxy-3-pyridinyl)propan-1-amine
CID 103148933
1-(5-propan-2-yloxy-3-pyridinyl)-2-propylpentan-1-one
CID 115794638
3-hexan-2-yl-5-(trifluoromethyl)pyridine
CID 134266462
1-[4-(difluoromethoxy)phenyl]-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105026047

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)-5-pentan-2-ylpyridine?
The IUPAC name of 3-(difluoromethoxy)-5-pentan-2-ylpyridine (CID 166854522) is 3-(difluoromethoxy)-5-pentan-2-ylpyridine.
What is the SMILES notation for 3-(difluoromethoxy)-5-pentan-2-ylpyridine?
The canonical SMILES for 3-(difluoromethoxy)-5-pentan-2-ylpyridine is CCCC(C)c1cncc(OC(F)F)c1.
What is the InChIKey of 3-(difluoromethoxy)-5-pentan-2-ylpyridine?
The InChIKey is DMPZEWYQEXWSKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NO/c1-3-4-8(2)9-5-10(7-14-6-9)15-11(12)13/h5-8,11H,3-4H2,1-2H3.
What are the key properties of 3-(difluoromethoxy)-5-pentan-2-ylpyridine?
3-(difluoromethoxy)-5-pentan-2-ylpyridine has a molecular weight of 215.24 g/mol, XLogP of 3.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxy)-5-pentan-2-ylpyridine is sourced from PubChem (CID 166854522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).