2,4-dimethoxy-5-(2-methylpropyl)pyrimidine

C10H16N2O2 — CID 59569180

IUPAC2,4-dimethoxy-5-(2-methylpropyl)pyrimidine
SMILESCOc1ncc(CC(C)C)c(OC)n1
InChIInChI=1S/C10H16N2O2/c1-7(2)5-8-6-11-10(14-4)12-9(8)13-3/h6-7H,5H2,1-4H3
InChIKeyJEPJFWLNUFJNGR-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.69
Rot. Bonds4

About 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine

2,4-dimethoxy-5-(2-methylpropyl)pyrimidine (PubChem CID 59569180) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine.

Molecular Properties

Compound Name2,4-dimethoxy-5-(2-methylpropyl)pyrimidine
PubChem CID59569180
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name2,4-dimethoxy-5-(2-methylpropyl)pyrimidine
SMILESCOc1ncc(CC(C)C)c(OC)n1
InChIInChI=1S/C10H16N2O2/c1-7(2)5-8-6-11-10(14-4)12-9(8)13-3/h6-7H,5H2,1-4H3
InChIKeyJEPJFWLNUFJNGR-UHFFFAOYSA-N
XLogP1.69
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine?
The IUPAC name of 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine (CID 59569180) is 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine.
What is the SMILES notation for 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine?
The canonical SMILES for 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine is COc1ncc(CC(C)C)c(OC)n1.
What is the InChIKey of 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine?
The InChIKey is JEPJFWLNUFJNGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7(2)5-8-6-11-10(14-4)12-9(8)13-3/h6-7H,5H2,1-4H3.
What are the key properties of 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine?
2,4-dimethoxy-5-(2-methylpropyl)pyrimidine has a molecular weight of 196.25 g/mol, XLogP of 1.69, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-5-(2-methylpropyl)pyrimidine is sourced from PubChem (CID 59569180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).