2-(1,1-difluoropropyl)pyridine

C8H9F2N — CID 59088790

IUPAC2-(1,1-difluoropropyl)pyridine
SMILESCCC(F)(F)c1ccccn1
InChIInChI=1S/C8H9F2N/c1-2-8(9,10)7-5-3-4-6-11-7/h3-6H,2H2,1H3
InChIKeyKHHWKZIVVORCSS-UHFFFAOYSA-N
MW157.16 g/mol
LogP2.58
Rot. Bonds2

About 2-(1,1-difluoropropyl)pyridine

2-(1,1-difluoropropyl)pyridine (PubChem CID 59088790) has the molecular formula C8H9F2N and a molecular weight of 157.16 g/mol. Its IUPAC name is 2-(1,1-difluoropropyl)pyridine.

Molecular Properties

Compound Name2-(1,1-difluoropropyl)pyridine
PubChem CID59088790
Molecular FormulaC8H9F2N
Molecular Weight157.16 g/mol
Exact Mass157.07
IUPAC Name2-(1,1-difluoropropyl)pyridine
SMILESCCC(F)(F)c1ccccn1
InChIInChI=1S/C8H9F2N/c1-2-8(9,10)7-5-3-4-6-11-7/h3-6H,2H2,1H3
InChIKeyKHHWKZIVVORCSS-UHFFFAOYSA-N
XLogP2.58
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.16
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-chloro-1,1-difluoropropyl)pyridine
CID 178189978
1-pyridin-2-ylpropane-1,1-diol
CID 18373059
2-(1,1-difluoro-2-methylpropyl)pyridine
CID 116841481
2-(2-ethoxybutan-2-yl)pyridine
CID 146396878
2-(3-fluoro-5-methylhexan-3-yl)pyridine
CID 146397049
ethyl 3,3-difluoro-3-pyridin-2-ylpropanoate
CID 83853858
fluoro(pyridin-2-yl)methanediamine
CID 67406744
5,5-difluoro-5-pyridin-2-ylpentan-1-ol
CID 134969379
difluoro(pyridin-2-yl)methanamine
CID 83854913
2-(2-azido-1,1-difluoroethyl)pyridine
CID 11805405
(1S)-1-phenyl-1-pyridin-2-ylpropan-1-ol
CID 12522815
3-ethyl-3-pyridin-2-ylpentan-1-amine
CID 83818225

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoropropyl)pyridine?
The IUPAC name of 2-(1,1-difluoropropyl)pyridine (CID 59088790) is 2-(1,1-difluoropropyl)pyridine.
What is the SMILES notation for 2-(1,1-difluoropropyl)pyridine?
The canonical SMILES for 2-(1,1-difluoropropyl)pyridine is CCC(F)(F)c1ccccn1.
What is the InChIKey of 2-(1,1-difluoropropyl)pyridine?
The InChIKey is KHHWKZIVVORCSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2N/c1-2-8(9,10)7-5-3-4-6-11-7/h3-6H,2H2,1H3.
What are the key properties of 2-(1,1-difluoropropyl)pyridine?
2-(1,1-difluoropropyl)pyridine has a molecular weight of 157.16 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoropropyl)pyridine is sourced from PubChem (CID 59088790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).