2,4-bis(phenylmethoxy)pyrimidine

C18H16N2O2 — CID 10447380

IUPAC2,4-bis(phenylmethoxy)pyrimidine
SMILESc1ccc(COc2ccnc(OCc3ccccc3)n2)cc1
InChIInChI=1S/C18H16N2O2/c1-3-7-15(8-4-1)13-21-17-11-12-19-18(20-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2
InChIKeyUYMTZUCWZADKHO-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.63
Rot. Bonds6

About 2,4-bis(phenylmethoxy)pyrimidine

2,4-bis(phenylmethoxy)pyrimidine (PubChem CID 10447380) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2,4-bis(phenylmethoxy)pyrimidine.

Molecular Properties

Compound Name2,4-bis(phenylmethoxy)pyrimidine
PubChem CID10447380
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name2,4-bis(phenylmethoxy)pyrimidine
SMILESc1ccc(COc2ccnc(OCc3ccccc3)n2)cc1
InChIInChI=1S/C18H16N2O2/c1-3-7-15(8-4-1)13-21-17-11-12-19-18(20-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2
InChIKeyUYMTZUCWZADKHO-UHFFFAOYSA-N
XLogP3.63
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-bis(phenylmethoxy)pyrimidine?
The IUPAC name of 2,4-bis(phenylmethoxy)pyrimidine (CID 10447380) is 2,4-bis(phenylmethoxy)pyrimidine.
What is the SMILES notation for 2,4-bis(phenylmethoxy)pyrimidine?
The canonical SMILES for 2,4-bis(phenylmethoxy)pyrimidine is c1ccc(COc2ccnc(OCc3ccccc3)n2)cc1.
What is the InChIKey of 2,4-bis(phenylmethoxy)pyrimidine?
The InChIKey is UYMTZUCWZADKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c1-3-7-15(8-4-1)13-21-17-11-12-19-18(20-17)22-14-16-9-5-2-6-10-16/h1-12H,13-14H2.
What are the key properties of 2,4-bis(phenylmethoxy)pyrimidine?
2,4-bis(phenylmethoxy)pyrimidine has a molecular weight of 292.34 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(phenylmethoxy)pyrimidine is sourced from PubChem (CID 10447380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).