4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine

C11H15N5O — CID 114053325

IUPAC4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine
SMILESCCCc1nccn1-c1cc(OC)nc(N)n1
InChIInChI=1S/C11H15N5O/c1-3-4-8-13-5-6-16(8)9-7-10(17-2)15-11(12)14-9/h5-7H,3-4H2,1-2H3,(H2,12,14,15)
InChIKeyVBMUOESTNJKLLE-UHFFFAOYSA-N
MW233.28 g/mol
LogP1.21
Rot. Bonds4

About 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine

4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine (PubChem CID 114053325) has the molecular formula C11H15N5O and a molecular weight of 233.28 g/mol. Its IUPAC name is 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine
PubChem CID114053325
Molecular FormulaC11H15N5O
Molecular Weight233.28 g/mol
Exact Mass233.13
IUPAC Name4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine
SMILESCCCc1nccn1-c1cc(OC)nc(N)n1
InChIInChI=1S/C11H15N5O/c1-3-4-8-13-5-6-16(8)9-7-10(17-2)15-11(12)14-9/h5-7H,3-4H2,1-2H3,(H2,12,14,15)
InChIKeyVBMUOESTNJKLLE-UHFFFAOYSA-N
XLogP1.21
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.28
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine?
The IUPAC name of 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine (CID 114053325) is 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine?
The canonical SMILES for 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine is CCCc1nccn1-c1cc(OC)nc(N)n1.
What is the InChIKey of 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine?
The InChIKey is VBMUOESTNJKLLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O/c1-3-4-8-13-5-6-16(8)9-7-10(17-2)15-11(12)14-9/h5-7H,3-4H2,1-2H3,(H2,12,14,15).
What are the key properties of 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine?
4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine has a molecular weight of 233.28 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-(2-propylimidazol-1-yl)pyrimidin-2-amine is sourced from PubChem (CID 114053325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).