[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine

C11H19N3O — CID 106815543

IUPAC[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine
SMILESCCOCCc1nc(C)c(CN)c(C)n1
InChIInChI=1S/C11H19N3O/c1-4-15-6-5-11-13-8(2)10(7-12)9(3)14-11/h4-7,12H2,1-3H3
InChIKeyXQLDDLFHDQSXIC-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.13
Rot. Bonds5

About [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine

[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine (PubChem CID 106815543) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine.

Molecular Properties

Compound Name[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine
PubChem CID106815543
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine
SMILESCCOCCc1nc(C)c(CN)c(C)n1
InChIInChI=1S/C11H19N3O/c1-4-15-6-5-11-13-8(2)10(7-12)9(3)14-11/h4-7,12H2,1-3H3
InChIKeyXQLDDLFHDQSXIC-UHFFFAOYSA-N
XLogP1.13
TPSA61.03 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 ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-2-(2-ethoxyethyl)-5-ethyl-6-methylpyrimidine
CID 106814990
4,6-dichloro-2-(2-ethoxyethyl)-5-ethylpyrimidine
CID 106815000
3-[4,6-dimethyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]pyrimidin-5-yl]propan-1-amine
CID 103150794
[2-(2-ethoxyethyl)pyrimidin-4-yl]methanamine
CID 106815490
2-[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]-N-ethylpropan-1-amine
CID 106815566
2-[3-(2-ethoxyethyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 106814794
3-(4,6-dimethyl-2-propylpyrimidin-5-yl)propan-1-amine
CID 62745596
2-[3-(2-ethoxyethyl)-1,2,4-oxadiazol-5-yl]-4-methylpentan-1-amine
CID 106814760
N-ethyl-3-[2-[2-(2-methoxyethoxy)ethyl]-4,6-dimethylpyrimidin-5-yl]propan-1-amine
CID 102929114
N-[2-[2-[2-(2-methoxyethoxy)ethyl]-4,6-dimethylpyrimidin-5-yl]ethyl]propan-1-amine
CID 102929117
[2-(2-ethoxyethyl)-5-methyl-6-phenylpyrimidin-4-yl]hydrazine
CID 106815391
5-bromo-6-tert-butyl-2-(2-ethoxyethyl)pyrimidin-4-amine
CID 106815293

Frequently Asked Questions

What is the IUPAC name of [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine?
The IUPAC name of [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine (CID 106815543) is [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine.
What is the SMILES notation for [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine?
The canonical SMILES for [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine is CCOCCc1nc(C)c(CN)c(C)n1.
What is the InChIKey of [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine?
The InChIKey is XQLDDLFHDQSXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-4-15-6-5-11-13-8(2)10(7-12)9(3)14-11/h4-7,12H2,1-3H3.
What are the key properties of [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine?
[2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine has a molecular weight of 209.29 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-ethoxyethyl)-4,6-dimethylpyrimidin-5-yl]methanamine is sourced from PubChem (CID 106815543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).