2,4-di(propan-2-yl)pyrimidine

C10H16N2 — CID 20741620

IUPAC2,4-di(propan-2-yl)pyrimidine
SMILESCC(C)c1ccnc(C(C)C)n1
InChIInChI=1S/C10H16N2/c1-7(2)9-5-6-11-10(12-9)8(3)4/h5-8H,1-4H3
InChIKeyUUHJUJUUJHECOS-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.72
Rot. Bonds2

About 2,4-di(propan-2-yl)pyrimidine

2,4-di(propan-2-yl)pyrimidine (PubChem CID 20741620) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 2,4-di(propan-2-yl)pyrimidine.

Molecular Properties

Compound Name2,4-di(propan-2-yl)pyrimidine
PubChem CID20741620
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name2,4-di(propan-2-yl)pyrimidine
SMILESCC(C)c1ccnc(C(C)C)n1
InChIInChI=1S/C10H16N2/c1-7(2)9-5-6-11-10(12-9)8(3)4/h5-8H,1-4H3
InChIKeyUUHJUJUUJHECOS-UHFFFAOYSA-N
XLogP2.72
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-di(propan-2-yl)pyrimidine?
The IUPAC name of 2,4-di(propan-2-yl)pyrimidine (CID 20741620) is 2,4-di(propan-2-yl)pyrimidine.
What is the SMILES notation for 2,4-di(propan-2-yl)pyrimidine?
The canonical SMILES for 2,4-di(propan-2-yl)pyrimidine is CC(C)c1ccnc(C(C)C)n1.
What is the InChIKey of 2,4-di(propan-2-yl)pyrimidine?
The InChIKey is UUHJUJUUJHECOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-7(2)9-5-6-11-10(12-9)8(3)4/h5-8H,1-4H3.
What are the key properties of 2,4-di(propan-2-yl)pyrimidine?
2,4-di(propan-2-yl)pyrimidine has a molecular weight of 164.25 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-di(propan-2-yl)pyrimidine is sourced from PubChem (CID 20741620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).