4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one

C11H18N4O2 — CID 135978215

IUPAC4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
SMILESCCNCc1cc(=O)[nH]c(N2CCOCC2)n1
InChIInChI=1S/C11H18N4O2/c1-2-12-8-9-7-10(16)14-11(13-9)15-3-5-17-6-4-15/h7,12H,2-6,8H2,1H3,(H,13,14,16)
InChIKeyDFOGVYRXGSBUDA-UHFFFAOYSA-N
MW238.29 g/mol
LogP-0.28
Rot. Bonds4

About 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one

4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one (PubChem CID 135978215) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
PubChem CID135978215
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one
SMILESCCNCc1cc(=O)[nH]c(N2CCOCC2)n1
InChIInChI=1S/C11H18N4O2/c1-2-12-8-9-7-10(16)14-11(13-9)15-3-5-17-6-4-15/h7,12H,2-6,8H2,1H3,(H,13,14,16)
InChIKeyDFOGVYRXGSBUDA-UHFFFAOYSA-N
XLogP-0.28
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-methylbutyl)-2-morpholin-4-yl-1H-pyrimidin-6-one;hydrochloride
CID 163329753
4-(methylaminomethyl)-2-(4-methylpiperazin-1-yl)-1H-pyrimidin-6-one
CID 135978265
2-(4-phenylpiperazin-1-yl)-4-propyl-1H-pyrimidin-6-one
CID 135456330
cis-(1S,2R)-2-methyl-N-[(6-oxo-2-pyrrolidin-1-yl-1H-pyrimidin-4-yl)methyl]cyclopropane-1-carboxamide
CID 136891751
2-(4-aminopiperidin-1-yl)-4-ethyl-1H-pyrimidin-6-one
CID 136740823
2-cyclohexyl-N-[(1R)-1-(4-fluorophenyl)-2-(2-morpholin-4-yl-6-oxo-1H-pyrimidin-4-yl)ethyl]acetamide
CID 136681378
3-ethyl-N-[(1S)-1-(4-fluorophenyl)-2-(2-morpholin-4-yl-6-oxo-1H-pyrimidin-4-yl)ethyl]imidazole-4-carboxamide
CID 136851036
N-[(1R)-2-(2-morpholin-4-yl-6-oxo-1H-pyrimidin-4-yl)-1-phenylethyl]-2-piperidin-1-ylacetamide
CID 136682047
N-[(1R)-1-(4-fluorophenyl)-2-(2-morpholin-4-yl-6-oxo-1H-pyrimidin-4-yl)ethyl]-1-methylpyrazole-3-carboxamide
CID 136764050
2,4-dimethyl-N-[2-(2-morpholin-4-yl-6-oxo-1H-pyrimidin-4-yl)-1-phenylethyl]-1,3-thiazole-5-carboxamide
CID 136858775
N-[(1R)-1-(4-fluorophenyl)-2-(2-morpholin-4-yl-6-oxo-1H-pyrimidin-4-yl)ethyl]-1-methylimidazole-4-carboxamide
CID 136764028
4-(chloromethyl)-2-piperidin-1-yl-1H-pyrimidin-6-one
CID 135978506

Frequently Asked Questions

What is the IUPAC name of 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one (CID 135978215) is 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one is CCNCc1cc(=O)[nH]c(N2CCOCC2)n1.
What is the InChIKey of 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
The InChIKey is DFOGVYRXGSBUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-2-12-8-9-7-10(16)14-11(13-9)15-3-5-17-6-4-15/h7,12H,2-6,8H2,1H3,(H,13,14,16).
What are the key properties of 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one?
4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one has a molecular weight of 238.29 g/mol, XLogP of -0.28, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylaminomethyl)-2-morpholin-4-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 135978215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).