2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine

C16H16FN — CID 123665063

IUPAC2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine
SMILESCc1cc(-c2cc(F)ccc2C)cc(C2CC2)n1
InChIInChI=1S/C16H16FN/c1-10-3-6-14(17)9-15(10)13-7-11(2)18-16(8-13)12-4-5-12/h3,6-9,12H,4-5H2,1-2H3
InChIKeyYXXGHGABYZHDIG-UHFFFAOYSA-N
MW241.31 g/mol
LogP4.38
Rot. Bonds2

About 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine

2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine (PubChem CID 123665063) has the molecular formula C16H16FN and a molecular weight of 241.31 g/mol. Its IUPAC name is 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine.

Molecular Properties

Compound Name2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine
PubChem CID123665063
Molecular FormulaC16H16FN
Molecular Weight241.31 g/mol
Exact Mass241.13
IUPAC Name2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine
SMILESCc1cc(-c2cc(F)ccc2C)cc(C2CC2)n1
InChIInChI=1S/C16H16FN/c1-10-3-6-14(17)9-15(10)13-7-11(2)18-16(8-13)12-4-5-12/h3,6-9,12H,4-5H2,1-2H3
InChIKeyYXXGHGABYZHDIG-UHFFFAOYSA-N
XLogP4.38
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.31
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine?
The IUPAC name of 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine (CID 123665063) is 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine.
What is the SMILES notation for 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine?
The canonical SMILES for 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine is Cc1cc(-c2cc(F)ccc2C)cc(C2CC2)n1.
What is the InChIKey of 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine?
The InChIKey is YXXGHGABYZHDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN/c1-10-3-6-14(17)9-15(10)13-7-11(2)18-16(8-13)12-4-5-12/h3,6-9,12H,4-5H2,1-2H3.
What are the key properties of 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine?
2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine has a molecular weight of 241.31 g/mol, XLogP of 4.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(5-fluoro-2-methylphenyl)-6-methylpyridine is sourced from PubChem (CID 123665063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).