4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine

C12H8Cl2FNO — CID 133090712

IUPAC4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine
SMILESCOc1nccc(-c2cc(Cl)cc(Cl)c2)c1F
InChIInChI=1S/C12H8Cl2FNO/c1-17-12-11(15)10(2-3-16-12)7-4-8(13)6-9(14)5-7/h2-6H,1H3
InChIKeyADEYPPXWZOOJLW-UHFFFAOYSA-N
MW272.11 g/mol
LogP4.20
Rot. Bonds2

About 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine

4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine (PubChem CID 133090712) has the molecular formula C12H8Cl2FNO and a molecular weight of 272.11 g/mol. Its IUPAC name is 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine.

Molecular Properties

Compound Name4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine
PubChem CID133090712
Molecular FormulaC12H8Cl2FNO
Molecular Weight272.11 g/mol
Exact Mass271.00
IUPAC Name4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine
SMILESCOc1nccc(-c2cc(Cl)cc(Cl)c2)c1F
InChIInChI=1S/C12H8Cl2FNO/c1-17-12-11(15)10(2-3-16-12)7-4-8(13)6-9(14)5-7/h2-6H,1H3
InChIKeyADEYPPXWZOOJLW-UHFFFAOYSA-N
XLogP4.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.11
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-(3-fluoro-2-methoxy-4-pyridinyl)benzaldehyde
CID 114270434
2-fluoro-4-(3-fluoro-2-methoxy-4-pyridinyl)benzaldehyde
CID 114270433
3-(3,5-dichlorophenyl)-2-methylpyridine
CID 90167646
2-methoxy-3-(3,4,5-trichlorophenyl)pyridine
CID 134637897
2-fluoro-3-methoxy-4-(2,3,5-trichlorophenyl)pyridine
CID 134637483
3,4-dichloro-2-methoxypyridine
CID 57485134
N-ethyl-6-(3-fluoro-2-methoxy-4-pyridinyl)pyrimidin-4-amine
CID 114270502
5-chloro-2-methoxy-3-(3,4,5-trichlorophenyl)pyridine
CID 134637828
1,3-dichloro-5-(4-fluoro-3-methoxyphenyl)benzene
CID 134623746
3-fluoro-2-methoxy-4-(1-methyl-3-propan-2-ylpyrazol-4-yl)pyridine
CID 136571993
5-fluoro-2-methoxy-3-pyridin-4-ylpyridine
CID 46315714
1-(3-fluoro-2-methoxy-4-pyridinyl)propan-1-ol
CID 130506809

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine?
The IUPAC name of 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine (CID 133090712) is 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine.
What is the SMILES notation for 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine?
The canonical SMILES for 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine is COc1nccc(-c2cc(Cl)cc(Cl)c2)c1F.
What is the InChIKey of 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine?
The InChIKey is ADEYPPXWZOOJLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl2FNO/c1-17-12-11(15)10(2-3-16-12)7-4-8(13)6-9(14)5-7/h2-6H,1H3.
What are the key properties of 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine?
4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine has a molecular weight of 272.11 g/mol, XLogP of 4.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dichlorophenyl)-3-fluoro-2-methoxypyridine is sourced from PubChem (CID 133090712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).