5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine

C15H13F2N — CID 146292521

IUPAC5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine
SMILESC/C=C\c1ncc(-c2ccc(F)c(F)c2)cc1C
InChIInChI=1S/C15H13F2N/c1-3-4-15-10(2)7-12(9-18-15)11-5-6-13(16)14(17)8-11/h3-9H,1-2H3/b4-3-
InChIKeyRVGBJVKHEMDPHM-ARJAWSKDSA-N
MW245.27 g/mol
LogP4.37
Rot. Bonds2

About 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine

5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine (PubChem CID 146292521) has the molecular formula C15H13F2N and a molecular weight of 245.27 g/mol. Its IUPAC name is 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine.

Molecular Properties

Compound Name5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine
PubChem CID146292521
Molecular FormulaC15H13F2N
Molecular Weight245.27 g/mol
Exact Mass245.10
IUPAC Name5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine
SMILESC/C=C\c1ncc(-c2ccc(F)c(F)c2)cc1C
InChIInChI=1S/C15H13F2N/c1-3-4-15-10(2)7-12(9-18-15)11-5-6-13(16)14(17)8-11/h3-9H,1-2H3/b4-3-
InChIKeyRVGBJVKHEMDPHM-ARJAWSKDSA-N
XLogP4.37
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.27
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine?
The IUPAC name of 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine (CID 146292521) is 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine.
What is the SMILES notation for 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine?
The canonical SMILES for 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine is C/C=C\c1ncc(-c2ccc(F)c(F)c2)cc1C.
What is the InChIKey of 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine?
The InChIKey is RVGBJVKHEMDPHM-ARJAWSKDSA-N. The full InChI is InChI=1S/C15H13F2N/c1-3-4-15-10(2)7-12(9-18-15)11-5-6-13(16)14(17)8-11/h3-9H,1-2H3/b4-3-.
What are the key properties of 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine?
5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine has a molecular weight of 245.27 g/mol, XLogP of 4.37, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,4-difluorophenyl)-3-methyl-2-[(Z)-prop-1-enyl]pyridine is sourced from PubChem (CID 146292521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).