1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine

C11H19N3O — CID 116731058

IUPAC1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine
SMILESCCOC(C)(C)c1nccc(CNC)n1
InChIInChI=1S/C11H19N3O/c1-5-15-11(2,3)10-13-7-6-9(14-10)8-12-4/h6-7,12H,5,8H2,1-4H3
InChIKeySWYWHVJXTNLGDP-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.47
Rot. Bonds5

About 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine

1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine (PubChem CID 116731058) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine
PubChem CID116731058
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine
SMILESCCOC(C)(C)c1nccc(CNC)n1
InChIInChI=1S/C11H19N3O/c1-5-15-11(2,3)10-13-7-6-9(14-10)8-12-4/h6-7,12H,5,8H2,1-4H3
InChIKeySWYWHVJXTNLGDP-UHFFFAOYSA-N
XLogP1.47
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 ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-2-(2-ethoxypropan-2-yl)pyrimidine
CID 116706185
N-[[2-(2-methoxypropan-2-yl)pyrimidin-4-yl]methyl]propan-1-amine
CID 79198540
4-(chloromethyl)-2-(2-ethoxybutan-2-yl)pyrimidine
CID 116779049
1-[2-(1-methoxypropyl)pyrimidin-4-yl]-N-methylmethanamine
CID 116731053
2-(2-ethoxybutan-2-yl)-N-methylpyrimidin-4-amine
CID 116776051
1-[2-(1-ethoxycycloheptyl)pyrimidin-4-yl]-N-methylmethanamine
CID 116778481
1-(2-cyclobutylpyrimidin-4-yl)-N-methylmethanamine
CID 64985841
1-(2-cyclohexylpyrimidin-4-yl)-N-methylmethanamine
CID 62747376
N-methyl-1-[2-(2-methylcyclopropyl)pyrimidin-4-yl]methanamine
CID 65421316
N-[[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]methyl]propan-2-amine
CID 114206482
(1R)-1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanol
CID 103431278
1-[2-(2-ethoxypropan-2-yl)-4-methylpyrimidin-5-yl]ethanamine
CID 116731311

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine (CID 116731058) is 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine is CCOC(C)(C)c1nccc(CNC)n1.
What is the InChIKey of 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine?
The InChIKey is SWYWHVJXTNLGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-15-11(2,3)10-13-7-6-9(14-10)8-12-4/h6-7,12H,5,8H2,1-4H3.
What are the key properties of 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine?
1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine has a molecular weight of 209.29 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-ethoxypropan-2-yl)pyrimidin-4-yl]-N-methylmethanamine is sourced from PubChem (CID 116731058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).