5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine

C15H15ClFNO — CID 79727500

IUPAC5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
SMILESCc1cc(Oc2ncc(Cl)cc2F)ccc1C(C)C
InChIInChI=1S/C15H15ClFNO/c1-9(2)13-5-4-12(6-10(13)3)19-15-14(17)7-11(16)8-18-15/h4-9H,1-3H3
InChIKeyCIZYNYWGFKIICL-UHFFFAOYSA-N
MW279.74 g/mol
LogP5.10
Rot. Bonds3

About 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine

5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine (PubChem CID 79727500) has the molecular formula C15H15ClFNO and a molecular weight of 279.74 g/mol. Its IUPAC name is 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine.

Molecular Properties

Compound Name5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
PubChem CID79727500
Molecular FormulaC15H15ClFNO
Molecular Weight279.74 g/mol
Exact Mass279.08
IUPAC Name5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
SMILESCc1cc(Oc2ncc(Cl)cc2F)ccc1C(C)C
InChIInChI=1S/C15H15ClFNO/c1-9(2)13-5-4-12(6-10(13)3)19-15-14(17)7-11(16)8-18-15/h4-9H,1-3H3
InChIKeyCIZYNYWGFKIICL-UHFFFAOYSA-N
XLogP5.10
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500279.74
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-3-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine
CID 103583561
CID 67929203
CID 67929203
2-[4-[(5-chloro-3-fluoro-2-pyridinyl)oxy]phenoxy]propanoate
CID 22590912
4-chloro-5-methyl-6-(3-methyl-4-propan-2-ylphenoxy)pyrimidine
CID 63736409
3-chloro-4-(3-methyl-4-propan-2-ylphenoxy)-1,2,5-thiadiazole
CID 63506599
3-[(5-chloro-3-fluoro-2-pyridinyl)oxy]aniline
CID 79727242
5-methyl-4-(3-methyl-4-propan-2-ylphenoxy)pyrimidin-2-amine
CID 80863693
1-[3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 105391129
1,2-difluoro-4-methyl-5-(3-methyl-4-propan-2-ylphenoxy)benzene
CID 177076482
ethynyl 2-[4-[(5-chloro-3-fluoro-2-pyridinyl)oxy]phenoxy]propanoate
CID 139247839
6-chloro-2-(3-methyl-4-propan-2-ylphenoxy)pyridin-3-amine
CID 115474420
2-chloro-5-[(5-chloro-3-fluoro-2-pyridinyl)oxy]benzoic acid
CID 106502943

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
The IUPAC name of 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine (CID 79727500) is 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine.
What is the SMILES notation for 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
The canonical SMILES for 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine is Cc1cc(Oc2ncc(Cl)cc2F)ccc1C(C)C.
What is the InChIKey of 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
The InChIKey is CIZYNYWGFKIICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClFNO/c1-9(2)13-5-4-12(6-10(13)3)19-15-14(17)7-11(16)8-18-15/h4-9H,1-3H3.
What are the key properties of 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine?
5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine has a molecular weight of 279.74 g/mol, XLogP of 5.10, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-fluoro-2-(3-methyl-4-propan-2-ylphenoxy)pyridine is sourced from PubChem (CID 79727500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).