4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine

C11H20N4O — CID 82455505

IUPAC4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
SMILESCCNc1nc(C)nc(OCC(C)C)c1N
InChIInChI=1S/C11H20N4O/c1-5-13-10-9(12)11(15-8(4)14-10)16-6-7(2)3/h7H,5-6,12H2,1-4H3,(H,13,14,15)
InChIKeyURQGGCRECPPUGN-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.83
Rot. Bonds5

About 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine

4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine (PubChem CID 82455505) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine.

Molecular Properties

Compound Name4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
PubChem CID82455505
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
SMILESCCNc1nc(C)nc(OCC(C)C)c1N
InChIInChI=1S/C11H20N4O/c1-5-13-10-9(12)11(15-8(4)14-10)16-6-7(2)3/h7H,5-6,12H2,1-4H3,(H,13,14,15)
InChIKeyURQGGCRECPPUGN-UHFFFAOYSA-N
XLogP1.83
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-butyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455513
4-N-ethyl-6-(2-methylpropoxy)-2-(2-methylpropyl)pyrimidine-4,5-diamine
CID 82458307
4-N-cyclopropyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455507
4-N-(3-ethoxypropyl)-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455515
4-N-cyclohexyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455531
2-methyl-4-N-[(4-methylphenyl)methyl]-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455532
4-N-[(4-fluorophenyl)methyl]-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82455541
4-N-ethyl-6-(2-methylpropoxy)-2-(oxolan-2-yl)pyrimidine-4,5-diamine
CID 82457926
4-N-tert-butyl-6-(2-methylpropoxy)-2-propylpyrimidine-4,5-diamine
CID 82456109
N-ethyl-5-methyl-6-(2-methylpropoxy)-2-propylpyrimidin-4-amine
CID 80988348
4-N-butan-2-yl-2-tert-butyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine
CID 82458799
6-butoxy-2-methyl-4-N-pentylpyrimidine-4,5-diamine
CID 82455487

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
The IUPAC name of 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine (CID 82455505) is 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine.
What is the SMILES notation for 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
The canonical SMILES for 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine is CCNc1nc(C)nc(OCC(C)C)c1N.
What is the InChIKey of 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
The InChIKey is URQGGCRECPPUGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-5-13-10-9(12)11(15-8(4)14-10)16-6-7(2)3/h7H,5-6,12H2,1-4H3,(H,13,14,15).
What are the key properties of 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine?
4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine has a molecular weight of 224.31 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-2-methyl-6-(2-methylpropoxy)pyrimidine-4,5-diamine is sourced from PubChem (CID 82455505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).