3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine

C15H16FNO — CID 167219030

IUPAC3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine
SMILESCOc1ncc(-c2cccc(C(C)C)c2)cc1F
InChIInChI=1S/C15H16FNO/c1-10(2)11-5-4-6-12(7-11)13-8-14(16)15(18-3)17-9-13/h4-10H,1-3H3
InChIKeyGSRGSOHZXBQSED-UHFFFAOYSA-N
MW245.30 g/mol
LogP4.02
Rot. Bonds3

About 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine

3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine (PubChem CID 167219030) has the molecular formula C15H16FNO and a molecular weight of 245.30 g/mol. Its IUPAC name is 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine.

Molecular Properties

Compound Name3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine
PubChem CID167219030
Molecular FormulaC15H16FNO
Molecular Weight245.30 g/mol
Exact Mass245.12
IUPAC Name3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine
SMILESCOc1ncc(-c2cccc(C(C)C)c2)cc1F
InChIInChI=1S/C15H16FNO/c1-10(2)11-5-4-6-12(7-11)13-8-14(16)15(18-3)17-9-13/h4-10H,1-3H3
InChIKeyGSRGSOHZXBQSED-UHFFFAOYSA-N
XLogP4.02
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-3-methyl-5-(3-propan-2-ylphenyl)pyridine
CID 67679272
1-methoxy-3-(3-propan-2-ylphenyl)benzene
CID 23110868
3-fluoro-2-methoxy-5-pyridin-2-ylpyridine
CID 175955577
5-(2,3-dichlorophenyl)-3-fluoro-2-methoxypyridine
CID 133091081
2-methoxy-5-[3-(2-methylpyrazol-3-yl)-5-propan-2-ylphenyl]-3-(3-propan-2-ylphenyl)pyridine
CID 134492428
1-methoxy-4-(3-propan-2-ylphenyl)benzene
CID 20871880
methyl 3-(5,6-dimethoxy-3-pyridinyl)benzoate
CID 90046409
3-(5,6-dimethoxy-3-pyridinyl)benzonitrile
CID 90046523
1-fluoro-2-(3-propan-2-ylphenyl)benzene
CID 20871867
5-(3-fluorophenyl)-2-methoxypyridine-3-carboxylic acid
CID 46314070
5-(3-propan-2-ylphenyl)pyridine-2-carboxamide
CID 123211569
3-chloro-4-(3-propan-2-ylphenyl)pyridine
CID 145490955

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine?
The IUPAC name of 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine (CID 167219030) is 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine.
What is the SMILES notation for 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine?
The canonical SMILES for 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine is COc1ncc(-c2cccc(C(C)C)c2)cc1F.
What is the InChIKey of 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine?
The InChIKey is GSRGSOHZXBQSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO/c1-10(2)11-5-4-6-12(7-11)13-8-14(16)15(18-3)17-9-13/h4-10H,1-3H3.
What are the key properties of 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine?
3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine has a molecular weight of 245.30 g/mol, XLogP of 4.02, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-2-methoxy-5-(3-propan-2-ylphenyl)pyridine is sourced from PubChem (CID 167219030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).