2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine

C10H17N3O2 — CID 80876486

IUPAC2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine
SMILESCCCOCCOc1cc(N)nc(C)n1
InChIInChI=1S/C10H17N3O2/c1-3-4-14-5-6-15-10-7-9(11)12-8(2)13-10/h7H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyRRTDWRMBOOWREO-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.17
Rot. Bonds6

About 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine

2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine (PubChem CID 80876486) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine
PubChem CID80876486
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine
SMILESCCCOCCOc1cc(N)nc(C)n1
InChIInChI=1S/C10H17N3O2/c1-3-4-14-5-6-15-10-7-9(11)12-8(2)13-10/h7H,3-6H2,1-2H3,(H2,11,12,13)
InChIKeyRRTDWRMBOOWREO-UHFFFAOYSA-N
XLogP1.17
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The IUPAC name of 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine (CID 80876486) is 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine is CCCOCCOc1cc(N)nc(C)n1.
What is the InChIKey of 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
The InChIKey is RRTDWRMBOOWREO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-4-14-5-6-15-10-7-9(11)12-8(2)13-10/h7H,3-6H2,1-2H3,(H2,11,12,13).
What are the key properties of 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine?
2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine has a molecular weight of 211.26 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-propoxyethoxy)pyrimidin-4-amine is sourced from PubChem (CID 80876486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).