2-(2,4-difluorophenyl)-4-methoxypyrimidine

C11H8F2N2O — CID 141051307

IUPAC2-(2,4-difluorophenyl)-4-methoxypyrimidine
SMILESCOc1ccnc(-c2ccc(F)cc2F)n1
InChIInChI=1S/C11H8F2N2O/c1-16-10-4-5-14-11(15-10)8-3-2-7(12)6-9(8)13/h2-6H,1H3
InChIKeyWNFJODDTBDOSKE-UHFFFAOYSA-N
MW222.19 g/mol
LogP2.43
Rot. Bonds2

About 2-(2,4-difluorophenyl)-4-methoxypyrimidine

2-(2,4-difluorophenyl)-4-methoxypyrimidine (PubChem CID 141051307) has the molecular formula C11H8F2N2O and a molecular weight of 222.19 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-4-methoxypyrimidine.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-4-methoxypyrimidine
PubChem CID141051307
Molecular FormulaC11H8F2N2O
Molecular Weight222.19 g/mol
Exact Mass222.06
IUPAC Name2-(2,4-difluorophenyl)-4-methoxypyrimidine
SMILESCOc1ccnc(-c2ccc(F)cc2F)n1
InChIInChI=1S/C11H8F2N2O/c1-16-10-4-5-14-11(15-10)8-3-2-7(12)6-9(8)13/h2-6H,1H3
InChIKeyWNFJODDTBDOSKE-UHFFFAOYSA-N
XLogP2.43
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.19
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-difluorophenyl)-3-methoxypyridine
CID 90122660
2-(2,4-difluorophenyl)-4-methoxypyridine;2,3-dimethylbutane
CID 145210804
4-(2,4-difluorophenyl)-2-phenylpyrimidine
CID 172796128
[5-fluoro-2-(2-methoxy-4-pyridinyl)phenyl]methanamine
CID 114078578
2-[4-(2,4-difluorophenoxy)piperidin-1-yl]-4-methoxypyrimidine
CID 154833904
4-methoxy-2-(1-methylimidazol-4-yl)pyrimidine
CID 59830304
(7R)-2-amino-7-[4-fluoro-2-(4-methoxypyrimidin-2-yl)phenyl]-4-methyl-7,8-dihydro-6H-pyrido[4,3-d]pyrimidin-5-one
CID 57424817
6-fluoro-2-methoxyindeno[2,3-b]pyridin-9-one
CID 155039769
2-(3-tert-butylpyrazol-1-yl)-4-[2-[2-(2,4-difluorophenyl)pyrimidin-4-yl]propan-2-yl]pyrimidine
CID 59646022
2-chloro-4-(4-fluoro-2-methoxyphenyl)pyrimidine
CID 24901904
2,4-bis(2,4-difluorophenyl)-6-phenyl-1,3,5-triazine
CID 138569840
[2-[4-[(5-chloro-3-fluoro-2-pyridinyl)oxy]-2-fluorophenyl]pyrimidin-4-yl] acetate
CID 175585681

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-4-methoxypyrimidine?
The IUPAC name of 2-(2,4-difluorophenyl)-4-methoxypyrimidine (CID 141051307) is 2-(2,4-difluorophenyl)-4-methoxypyrimidine.
What is the SMILES notation for 2-(2,4-difluorophenyl)-4-methoxypyrimidine?
The canonical SMILES for 2-(2,4-difluorophenyl)-4-methoxypyrimidine is COc1ccnc(-c2ccc(F)cc2F)n1.
What is the InChIKey of 2-(2,4-difluorophenyl)-4-methoxypyrimidine?
The InChIKey is WNFJODDTBDOSKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2N2O/c1-16-10-4-5-14-11(15-10)8-3-2-7(12)6-9(8)13/h2-6H,1H3.
What are the key properties of 2-(2,4-difluorophenyl)-4-methoxypyrimidine?
2-(2,4-difluorophenyl)-4-methoxypyrimidine has a molecular weight of 222.19 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-4-methoxypyrimidine is sourced from PubChem (CID 141051307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).