4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine

C11H19N3O — CID 80866608

IUPAC4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine
SMILESCCNc1nc(C)cc(OC(C)CC)n1
InChIInChI=1S/C11H19N3O/c1-5-9(4)15-10-7-8(3)13-11(14-10)12-6-2/h7,9H,5-6H2,1-4H3,(H,12,13,14)
InChIKeyPAJZQESXBFHPHP-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.39
Rot. Bonds5

About 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine

4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine (PubChem CID 80866608) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine
PubChem CID80866608
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine
SMILESCCNc1nc(C)cc(OC(C)CC)n1
InChIInChI=1S/C11H19N3O/c1-5-9(4)15-10-7-8(3)13-11(14-10)12-6-2/h7,9H,5-6H2,1-4H3,(H,12,13,14)
InChIKeyPAJZQESXBFHPHP-UHFFFAOYSA-N
XLogP2.39
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxypropyl)-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 102698965
4-methyl-6-(3-methylbutan-2-yloxy)-N-propylpyrimidin-2-amine
CID 80882608
4-(3,5-dimethylphenoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 80864393
N-ethyl-4-hexoxy-6-methylpyrimidin-2-amine
CID 80861146
4-cyclobutyloxy-N-ethyl-6-methylpyrimidin-2-amine
CID 80873770
N-ethyl-2-[(4-methyl-6-propan-2-yloxypyrimidin-2-yl)amino]acetamide
CID 112636791
4-(3,5-dichlorophenoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 80874616
4-methyl-N-(2-methylsulfanylethyl)-6-propan-2-yloxypyrimidin-2-amine
CID 112637747
N-[(2-butan-2-yloxy-6-methyl-4-pyridinyl)methyl]propan-1-amine
CID 113379516
N-(cyclobutylmethyl)-4-methyl-6-propan-2-yloxypyrimidin-2-amine
CID 112636641
4-(2-cyclopropylethoxy)-N-ethyl-6-methylpyrimidin-2-amine
CID 106207480
N-ethyl-4-methyl-6-(2,3,5-trimethylphenoxy)pyrimidin-2-amine
CID 80881926

Frequently Asked Questions

What is the IUPAC name of 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine?
The IUPAC name of 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine (CID 80866608) is 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine.
What is the SMILES notation for 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine?
The canonical SMILES for 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine is CCNc1nc(C)cc(OC(C)CC)n1.
What is the InChIKey of 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine?
The InChIKey is PAJZQESXBFHPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-9(4)15-10-7-8(3)13-11(14-10)12-6-2/h7,9H,5-6H2,1-4H3,(H,12,13,14).
What are the key properties of 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine?
4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine has a molecular weight of 209.29 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butan-2-yloxy-N-ethyl-6-methylpyrimidin-2-amine is sourced from PubChem (CID 80866608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).