6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine

C12H19N3O — CID 106207430

IUPAC6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine
SMILESCCCc1c(N)ncnc1OCCC1CC1
InChIInChI=1S/C12H19N3O/c1-2-3-10-11(13)14-8-15-12(10)16-7-6-9-4-5-9/h8-9H,2-7H2,1H3,(H2,13,14,15)
InChIKeyVMDHXYFPPJOUTP-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.19
Rot. Bonds6

About 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine

6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine (PubChem CID 106207430) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine
PubChem CID106207430
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine
SMILESCCCc1c(N)ncnc1OCCC1CC1
InChIInChI=1S/C12H19N3O/c1-2-3-10-11(13)14-8-15-12(10)16-7-6-9-4-5-9/h8-9H,2-7H2,1H3,(H2,13,14,15)
InChIKeyVMDHXYFPPJOUTP-UHFFFAOYSA-N
XLogP2.19
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine?
The IUPAC name of 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine (CID 106207430) is 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine?
The canonical SMILES for 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine is CCCc1c(N)ncnc1OCCC1CC1.
What is the InChIKey of 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine?
The InChIKey is VMDHXYFPPJOUTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-2-3-10-11(13)14-8-15-12(10)16-7-6-9-4-5-9/h8-9H,2-7H2,1H3,(H2,13,14,15).
What are the key properties of 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine?
6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine has a molecular weight of 221.30 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclopropylethoxy)-5-propylpyrimidin-4-amine is sourced from PubChem (CID 106207430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).