2-methoxy-4,6-diphenylpyrimidin-5-amine

C17H15N3O — CID 624065

IUPAC2-methoxy-4,6-diphenylpyrimidin-5-amine
SMILESCOc1nc(-c2ccccc2)c(N)c(-c2ccccc2)n1
InChIInChI=1S/C17H15N3O/c1-21-17-19-15(12-8-4-2-5-9-12)14(18)16(20-17)13-10-6-3-7-11-13/h2-11H,18H2,1H3
InChIKeyGFARVRPGYFBMBU-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.40
Rot. Bonds3

About 2-methoxy-4,6-diphenylpyrimidin-5-amine

2-methoxy-4,6-diphenylpyrimidin-5-amine (PubChem CID 624065) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-methoxy-4,6-diphenylpyrimidin-5-amine.

Molecular Properties

Compound Name2-methoxy-4,6-diphenylpyrimidin-5-amine
PubChem CID624065
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name2-methoxy-4,6-diphenylpyrimidin-5-amine
SMILESCOc1nc(-c2ccccc2)c(N)c(-c2ccccc2)n1
InChIInChI=1S/C17H15N3O/c1-21-17-19-15(12-8-4-2-5-9-12)14(18)16(20-17)13-10-6-3-7-11-13/h2-11H,18H2,1H3
InChIKeyGFARVRPGYFBMBU-UHFFFAOYSA-N
XLogP3.40
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,6-diphenylpyrimidin-5-amine?
The IUPAC name of 2-methoxy-4,6-diphenylpyrimidin-5-amine (CID 624065) is 2-methoxy-4,6-diphenylpyrimidin-5-amine.
What is the SMILES notation for 2-methoxy-4,6-diphenylpyrimidin-5-amine?
The canonical SMILES for 2-methoxy-4,6-diphenylpyrimidin-5-amine is COc1nc(-c2ccccc2)c(N)c(-c2ccccc2)n1.
What is the InChIKey of 2-methoxy-4,6-diphenylpyrimidin-5-amine?
The InChIKey is GFARVRPGYFBMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-21-17-19-15(12-8-4-2-5-9-12)14(18)16(20-17)13-10-6-3-7-11-13/h2-11H,18H2,1H3.
What are the key properties of 2-methoxy-4,6-diphenylpyrimidin-5-amine?
2-methoxy-4,6-diphenylpyrimidin-5-amine has a molecular weight of 277.33 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,6-diphenylpyrimidin-5-amine is sourced from PubChem (CID 624065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).