6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine

C14H23N3O — CID 114158255

IUPAC6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(N)nc(C(C)C)nc1OCCC1CCC1
InChIInChI=1S/C14H23N3O/c1-9(2)13-16-12(15)10(3)14(17-13)18-8-7-11-5-4-6-11/h9,11H,4-8H2,1-3H3,(H2,15,16,17)
InChIKeyOCEOURPQZSOXHO-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.06
Rot. Bonds5

About 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine

6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine (PubChem CID 114158255) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine
PubChem CID114158255
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine
SMILESCc1c(N)nc(C(C)C)nc1OCCC1CCC1
InChIInChI=1S/C14H23N3O/c1-9(2)13-16-12(15)10(3)14(17-13)18-8-7-11-5-4-6-11/h9,11H,4-8H2,1-3H3,(H2,15,16,17)
InChIKeyOCEOURPQZSOXHO-UHFFFAOYSA-N
XLogP3.06
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(2-cyclobutylethoxy)-2,5-dimethylpyrimidin-4-amine
CID 106207715
6-(2-cyclobutylethoxy)-N-ethyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 106207751
6-(3,3-dimethylbutoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80990527
5-methyl-2-propan-2-yl-6-(2-propan-2-yloxyethoxy)pyrimidin-4-amine
CID 80989543
5-methyl-6-(3-methylbut-3-enoxy)-2-propan-2-ylpyrimidin-4-amine
CID 114471200
5-methyl-2-propan-2-yl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 80988435
4-(2-cyclobutylethoxy)-5-methylpyrimidin-2-amine
CID 106207711
5-methyl-2-propan-2-yl-6-(2-thiophen-2-ylethoxy)pyrimidin-4-amine
CID 80990497
4-N-(cyclobutylmethyl)-4-N-ethyl-5-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 107403147
5-methyl-2-propan-2-yl-6-(thiophen-2-ylmethoxy)pyrimidin-4-amine
CID 80990262
5-methyl-6-(3-methylbutan-2-yloxy)-2-propan-2-ylpyrimidin-4-amine
CID 80991169
4-N-(cyclopropylmethyl)-5-methyl-4-N,2-di(propan-2-yl)pyrimidine-4,6-diamine
CID 80982410

Frequently Asked Questions

What is the IUPAC name of 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine (CID 114158255) is 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine is Cc1c(N)nc(C(C)C)nc1OCCC1CCC1.
What is the InChIKey of 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
The InChIKey is OCEOURPQZSOXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-9(2)13-16-12(15)10(3)14(17-13)18-8-7-11-5-4-6-11/h9,11H,4-8H2,1-3H3,(H2,15,16,17).
What are the key properties of 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine?
6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine has a molecular weight of 249.36 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclobutylethoxy)-5-methyl-2-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 114158255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).