2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine

C11H8ClFN2O — CID 63937747

IUPAC2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine
SMILESFc1ccccc1COc1ccnc(Cl)n1
InChIInChI=1S/C11H8ClFN2O/c12-11-14-6-5-10(15-11)16-7-8-3-1-2-4-9(8)13/h1-6H,7H2
InChIKeyGWBPKDTWVMYHSE-UHFFFAOYSA-N
MW238.65 g/mol
LogP2.85
Rot. Bonds3

About 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine

2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine (PubChem CID 63937747) has the molecular formula C11H8ClFN2O and a molecular weight of 238.65 g/mol. Its IUPAC name is 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine.

Molecular Properties

Compound Name2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine
PubChem CID63937747
Molecular FormulaC11H8ClFN2O
Molecular Weight238.65 g/mol
Exact Mass238.03
IUPAC Name2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine
SMILESFc1ccccc1COc1ccnc(Cl)n1
InChIInChI=1S/C11H8ClFN2O/c12-11-14-6-5-10(15-11)16-7-8-3-1-2-4-9(8)13/h1-6H,7H2
InChIKeyGWBPKDTWVMYHSE-UHFFFAOYSA-N
XLogP2.85
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.65
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine?
The IUPAC name of 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine (CID 63937747) is 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine.
What is the SMILES notation for 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine?
The canonical SMILES for 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine is Fc1ccccc1COc1ccnc(Cl)n1.
What is the InChIKey of 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine?
The InChIKey is GWBPKDTWVMYHSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2O/c12-11-14-6-5-10(15-11)16-7-8-3-1-2-4-9(8)13/h1-6H,7H2.
What are the key properties of 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine?
2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine has a molecular weight of 238.65 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-[(2-fluorophenyl)methoxy]pyrimidine is sourced from PubChem (CID 63937747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).