N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine

C12H20N4O — CID 83105196

IUPACN-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine
SMILESCCNCC1COCCN1c1ccnc(C)n1
InChIInChI=1S/C12H20N4O/c1-3-13-8-11-9-17-7-6-16(11)12-4-5-14-10(2)15-12/h4-5,11,13H,3,6-9H2,1-2H3
InChIKeyJLJRMLMFEDOMEK-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.60
Rot. Bonds4

About N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine

N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine (PubChem CID 83105196) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine
PubChem CID83105196
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine
SMILESCCNCC1COCCN1c1ccnc(C)n1
InChIInChI=1S/C12H20N4O/c1-3-13-8-11-9-17-7-6-16(11)12-4-5-14-10(2)15-12/h4-5,11,13H,3,6-9H2,1-2H3
InChIKeyJLJRMLMFEDOMEK-UHFFFAOYSA-N
XLogP0.60
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(4-pyrazin-2-ylmorpholin-3-yl)methyl]ethanamine
CID 83105613
N-[[4-(5-tert-butyl-2-pyridinyl)morpholin-3-yl]methyl]ethanamine
CID 107875507
N-methyl-1-[4-(4-methyl-2-pyridinyl)morpholin-3-yl]methanamine
CID 83104606
N-[[4-(6-propylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine
CID 83105610
N-[[4-[6-(trifluoromethyl)pyridazin-3-yl]morpholin-3-yl]methyl]ethanamine
CID 83105734
4-(2-methylpyrimidin-4-yl)-3-(2-pyrazin-2-ylethyl)morpholine
CID 110132157
N-[(4-quinazolin-2-ylmorpholin-3-yl)methyl]ethanamine
CID 114789779
N-[[4-(1,3,4-thiadiazol-2-yl)morpholin-3-yl]methyl]ethanamine
CID 83105363
N-[[4-(3-bromo-5-methyl-2-pyridinyl)morpholin-3-yl]methyl]ethanamine
CID 105368651
N-methyl-1-[4-(6-methyl-2-pyridinyl)morpholin-3-yl]methanamine
CID 83105038
N-[[6-(3-ethylmorpholin-4-yl)-2-pyridinyl]methyl]ethanamine
CID 62282778
[1-(2-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanol
CID 62770947

Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine?
The IUPAC name of N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine (CID 83105196) is N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine is CCNCC1COCCN1c1ccnc(C)n1.
What is the InChIKey of N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine?
The InChIKey is JLJRMLMFEDOMEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-3-13-8-11-9-17-7-6-16(11)12-4-5-14-10(2)15-12/h4-5,11,13H,3,6-9H2,1-2H3.
What are the key properties of N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine?
N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine has a molecular weight of 236.32 g/mol, XLogP of 0.60, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine is sourced from PubChem (CID 83105196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).