N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine

C14H24N4O2 — CID 62744964

IUPACN-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine
SMILESCOCCNCc1c(C)nc(N2CCOCC2)nc1C
InChIInChI=1S/C14H24N4O2/c1-11-13(10-15-4-7-19-3)12(2)17-14(16-11)18-5-8-20-9-6-18/h15H,4-10H2,1-3H3
InChIKeyMWTBEAUXSLLWPU-UHFFFAOYSA-N
MW280.37 g/mol
LogP0.67
Rot. Bonds6

About N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine

N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine (PubChem CID 62744964) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine.

Molecular Properties

Compound NameN-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine
PubChem CID62744964
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC NameN-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine
SMILESCOCCNCc1c(C)nc(N2CCOCC2)nc1C
InChIInChI=1S/C14H24N4O2/c1-11-13(10-15-4-7-19-3)12(2)17-14(16-11)18-5-8-20-9-6-18/h15H,4-10H2,1-3H3
InChIKeyMWTBEAUXSLLWPU-UHFFFAOYSA-N
XLogP0.67
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine?
The IUPAC name of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine (CID 62744964) is N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine.
What is the SMILES notation for N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine?
The canonical SMILES for N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine is COCCNCc1c(C)nc(N2CCOCC2)nc1C.
What is the InChIKey of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine?
The InChIKey is MWTBEAUXSLLWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-11-13(10-15-4-7-19-3)12(2)17-14(16-11)18-5-8-20-9-6-18/h15H,4-10H2,1-3H3.
What are the key properties of N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine?
N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine has a molecular weight of 280.37 g/mol, XLogP of 0.67, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,6-dimethyl-2-morpholin-4-ylpyrimidin-5-yl)methyl]-2-methoxyethanamine is sourced from PubChem (CID 62744964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).