4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine

C14H11F2N — CID 151088258

IUPAC4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine
SMILESC=C(C)c1cnccc1-c1cc(F)ccc1F
InChIInChI=1S/C14H11F2N/c1-9(2)13-8-17-6-5-11(13)12-7-10(15)3-4-14(12)16/h3-8H,1H2,2H3
InChIKeyMLONDOWNXQUCKF-UHFFFAOYSA-N
MW231.24 g/mol
LogP4.06
Rot. Bonds2

About 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine

4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine (PubChem CID 151088258) has the molecular formula C14H11F2N and a molecular weight of 231.24 g/mol. Its IUPAC name is 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine.

Molecular Properties

Compound Name4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine
PubChem CID151088258
Molecular FormulaC14H11F2N
Molecular Weight231.24 g/mol
Exact Mass231.09
IUPAC Name4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine
SMILESC=C(C)c1cnccc1-c1cc(F)ccc1F
InChIInChI=1S/C14H11F2N/c1-9(2)13-8-17-6-5-11(13)12-7-10(15)3-4-14(12)16/h3-8H,1H2,2H3
InChIKeyMLONDOWNXQUCKF-UHFFFAOYSA-N
XLogP4.06
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.24
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine?
The IUPAC name of 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine (CID 151088258) is 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine.
What is the SMILES notation for 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine?
The canonical SMILES for 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine is C=C(C)c1cnccc1-c1cc(F)ccc1F.
What is the InChIKey of 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine?
The InChIKey is MLONDOWNXQUCKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2N/c1-9(2)13-8-17-6-5-11(13)12-7-10(15)3-4-14(12)16/h3-8H,1H2,2H3.
What are the key properties of 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine?
4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine has a molecular weight of 231.24 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-difluorophenyl)-3-prop-1-en-2-ylpyridine is sourced from PubChem (CID 151088258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).