2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine

C10H17N3O — CID 79617094

IUPAC2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine
SMILESCOC(C)c1nc(N)cc(C(C)C)n1
InChIInChI=1S/C10H17N3O/c1-6(2)8-5-9(11)13-10(12-8)7(3)14-4/h5-7H,1-4H3,(H2,11,12,13)
InChIKeyBODIBAVKTOFHPC-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.89
Rot. Bonds3

About 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine

2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine (PubChem CID 79617094) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine
PubChem CID79617094
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine
SMILESCOC(C)c1nc(N)cc(C(C)C)n1
InChIInChI=1S/C10H17N3O/c1-6(2)8-5-9(11)13-10(12-8)7(3)14-4/h5-7H,1-4H3,(H2,11,12,13)
InChIKeyBODIBAVKTOFHPC-UHFFFAOYSA-N
XLogP1.89
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine (CID 79617094) is 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine is COC(C)c1nc(N)cc(C(C)C)n1.
What is the InChIKey of 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine?
The InChIKey is BODIBAVKTOFHPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-6(2)8-5-9(11)13-10(12-8)7(3)14-4/h5-7H,1-4H3,(H2,11,12,13).
What are the key properties of 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine?
2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine has a molecular weight of 195.27 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxyethyl)-6-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 79617094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).