4,6-dimethoxy-2-methylpyrimidin-5-amine

C7H11N3O2 — CID 21239200

IUPAC4,6-dimethoxy-2-methylpyrimidin-5-amine
SMILESCOc1nc(C)nc(OC)c1N
InChIInChI=1S/C7H11N3O2/c1-4-9-6(11-2)5(8)7(10-4)12-3/h8H2,1-3H3
InChIKeyDMUYKLGBDQYPCK-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.38
Rot. Bonds2

About 4,6-dimethoxy-2-methylpyrimidin-5-amine

4,6-dimethoxy-2-methylpyrimidin-5-amine (PubChem CID 21239200) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 4,6-dimethoxy-2-methylpyrimidin-5-amine.

Molecular Properties

Compound Name4,6-dimethoxy-2-methylpyrimidin-5-amine
PubChem CID21239200
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name4,6-dimethoxy-2-methylpyrimidin-5-amine
SMILESCOc1nc(C)nc(OC)c1N
InChIInChI=1S/C7H11N3O2/c1-4-9-6(11-2)5(8)7(10-4)12-3/h8H2,1-3H3
InChIKeyDMUYKLGBDQYPCK-UHFFFAOYSA-N
XLogP0.38
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-2-methylpyrimidin-5-amine?
The IUPAC name of 4,6-dimethoxy-2-methylpyrimidin-5-amine (CID 21239200) is 4,6-dimethoxy-2-methylpyrimidin-5-amine.
What is the SMILES notation for 4,6-dimethoxy-2-methylpyrimidin-5-amine?
The canonical SMILES for 4,6-dimethoxy-2-methylpyrimidin-5-amine is COc1nc(C)nc(OC)c1N.
What is the InChIKey of 4,6-dimethoxy-2-methylpyrimidin-5-amine?
The InChIKey is DMUYKLGBDQYPCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-4-9-6(11-2)5(8)7(10-4)12-3/h8H2,1-3H3.
What are the key properties of 4,6-dimethoxy-2-methylpyrimidin-5-amine?
4,6-dimethoxy-2-methylpyrimidin-5-amine has a molecular weight of 169.18 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-2-methylpyrimidin-5-amine is sourced from PubChem (CID 21239200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).