4,6-di(propan-2-yloxy)pyrimidin-5-amine

C10H17N3O2 — CID 15585367

IUPAC4,6-di(propan-2-yloxy)pyrimidin-5-amine
SMILESCC(C)Oc1ncnc(OC(C)C)c1N
InChIInChI=1S/C10H17N3O2/c1-6(2)14-9-8(11)10(13-5-12-9)15-7(3)4/h5-7H,11H2,1-4H3
InChIKeyDKPVEOLHDIZAIU-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.63
Rot. Bonds4

About 4,6-di(propan-2-yloxy)pyrimidin-5-amine

4,6-di(propan-2-yloxy)pyrimidin-5-amine (PubChem CID 15585367) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4,6-di(propan-2-yloxy)pyrimidin-5-amine.

Molecular Properties

Compound Name4,6-di(propan-2-yloxy)pyrimidin-5-amine
PubChem CID15585367
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name4,6-di(propan-2-yloxy)pyrimidin-5-amine
SMILESCC(C)Oc1ncnc(OC(C)C)c1N
InChIInChI=1S/C10H17N3O2/c1-6(2)14-9-8(11)10(13-5-12-9)15-7(3)4/h5-7H,11H2,1-4H3
InChIKeyDKPVEOLHDIZAIU-UHFFFAOYSA-N
XLogP1.63
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4,6-di(propan-2-yloxy)pyrimidin-5-amine?
The IUPAC name of 4,6-di(propan-2-yloxy)pyrimidin-5-amine (CID 15585367) is 4,6-di(propan-2-yloxy)pyrimidin-5-amine.
What is the SMILES notation for 4,6-di(propan-2-yloxy)pyrimidin-5-amine?
The canonical SMILES for 4,6-di(propan-2-yloxy)pyrimidin-5-amine is CC(C)Oc1ncnc(OC(C)C)c1N.
What is the InChIKey of 4,6-di(propan-2-yloxy)pyrimidin-5-amine?
The InChIKey is DKPVEOLHDIZAIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-6(2)14-9-8(11)10(13-5-12-9)15-7(3)4/h5-7H,11H2,1-4H3.
What are the key properties of 4,6-di(propan-2-yloxy)pyrimidin-5-amine?
4,6-di(propan-2-yloxy)pyrimidin-5-amine has a molecular weight of 211.26 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-di(propan-2-yloxy)pyrimidin-5-amine is sourced from PubChem (CID 15585367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).