4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine

C19H19N3O — CID 14281162

IUPAC4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine
SMILESCCCc1cc(OC)nc(-c2cccc(-c3ccccc3)n2)n1
InChIInChI=1S/C19H19N3O/c1-3-8-15-13-18(23-2)22-19(20-15)17-12-7-11-16(21-17)14-9-5-4-6-10-14/h4-7,9-13H,3,8H2,1-2H3
InChIKeyLGSSXCZWIGFTCV-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.17
Rot. Bonds5

About 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine

4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine (PubChem CID 14281162) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine.

Molecular Properties

Compound Name4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine
PubChem CID14281162
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine
SMILESCCCc1cc(OC)nc(-c2cccc(-c3ccccc3)n2)n1
InChIInChI=1S/C19H19N3O/c1-3-8-15-13-18(23-2)22-19(20-15)17-12-7-11-16(21-17)14-9-5-4-6-10-14/h4-7,9-13H,3,8H2,1-2H3
InChIKeyLGSSXCZWIGFTCV-UHFFFAOYSA-N
XLogP4.17
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine?
The IUPAC name of 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine (CID 14281162) is 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine.
What is the SMILES notation for 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine?
The canonical SMILES for 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine is CCCc1cc(OC)nc(-c2cccc(-c3ccccc3)n2)n1.
What is the InChIKey of 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine?
The InChIKey is LGSSXCZWIGFTCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-3-8-15-13-18(23-2)22-19(20-15)17-12-7-11-16(21-17)14-9-5-4-6-10-14/h4-7,9-13H,3,8H2,1-2H3.
What are the key properties of 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine?
4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine has a molecular weight of 305.38 g/mol, XLogP of 4.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine is sourced from PubChem (CID 14281162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).