1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine

C16H18FNO — CID 161445817

IUPAC1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine
SMILESC=C1C(C)=CC=C(c2c(F)cccc2OC)N1CC
InChIInChI=1S/C16H18FNO/c1-5-18-12(3)11(2)9-10-14(18)16-13(17)7-6-8-15(16)19-4/h6-10H,3,5H2,1-2,4H3
InChIKeyWWAVLTFHHODUBX-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.97
Rot. Bonds3

About 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine

1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine (PubChem CID 161445817) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine.

Molecular Properties

Compound Name1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine
PubChem CID161445817
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine
SMILESC=C1C(C)=CC=C(c2c(F)cccc2OC)N1CC
InChIInChI=1S/C16H18FNO/c1-5-18-12(3)11(2)9-10-14(18)16-13(17)7-6-8-15(16)19-4/h6-10H,3,5H2,1-2,4H3
InChIKeyWWAVLTFHHODUBX-UHFFFAOYSA-N
XLogP3.97
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-6-(2,6-difluorophenyl)-1-ethyl-2-methylidenepyridine
CID 161029028
1-ethyl-6-(2-fluoro-4-prop-2-enoxyphenyl)-3-methyl-2-methylidenepyridine
CID 159262861
6-(4-bromophenyl)-1-ethyl-3-methyl-2-methylidenepyridine
CID 149001165
1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
CID 46312197
3-(2-fluoro-6-methoxyphenyl)-N-methylaniline
CID 70269151
1-(2,2-difluoroethyl)-2-(2-fluoro-6-prop-2-ynoxyphenyl)-6-methylidenepyridine
CID 158087152
1-(2,2-difluoroethyl)-2-(2-fluoro-6-prop-2-ynoxyphenyl)-5-methyl-6-methylidene-3H-pyridin-3-ide;yttrium
CID 158178614
5-ethyl-3-(2-fluoro-6-methoxyphenyl)-1H-1,2,4-triazole
CID 65432102
2-(2,6-dimethoxyphenyl)-6-fluoroaniline
CID 107602899
4-fluoro-5-methoxy-9H-fluoren-9-amine
CID 82578577
1-fluoro-3-methoxy-2-[4-(trifluoromethyl)phenyl]benzene
CID 134631184
2-(2-fluoro-6-methoxyphenyl)pyridine
CID 66942163

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine?
The IUPAC name of 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine (CID 161445817) is 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine.
What is the SMILES notation for 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine?
The canonical SMILES for 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine is C=C1C(C)=CC=C(c2c(F)cccc2OC)N1CC.
What is the InChIKey of 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine?
The InChIKey is WWAVLTFHHODUBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-5-18-12(3)11(2)9-10-14(18)16-13(17)7-6-8-15(16)19-4/h6-10H,3,5H2,1-2,4H3.
What are the key properties of 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine?
1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine has a molecular weight of 259.32 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-(2-fluoro-6-methoxyphenyl)-3-methyl-2-methylidenepyridine is sourced from PubChem (CID 161445817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).