N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine

C13H22N4O — CID 80788166

IUPACN-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine
SMILESCCNc1ncnc(N2CCOC(CC)C2)c1C
InChIInChI=1S/C13H22N4O/c1-4-11-8-17(6-7-18-11)13-10(3)12(14-5-2)15-9-16-13/h9,11H,4-8H2,1-3H3,(H,14,15,16)
InChIKeyXIWOARQISUVSSW-UHFFFAOYSA-N
MW250.35 g/mol
LogP1.83
Rot. Bonds4

About N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine

N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine (PubChem CID 80788166) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine
PubChem CID80788166
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC NameN-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine
SMILESCCNc1ncnc(N2CCOC(CC)C2)c1C
InChIInChI=1S/C13H22N4O/c1-4-11-8-17(6-7-18-11)13-10(3)12(14-5-2)15-9-16-13/h9,11H,4-8H2,1-3H3,(H,14,15,16)
InChIKeyXIWOARQISUVSSW-UHFFFAOYSA-N
XLogP1.83
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-ethyl-6-(2-ethylmorpholin-4-yl)-N-propylpyrimidin-4-amine
CID 80786757
N-ethyl-5-methyl-6-(1,4-oxazepan-4-yl)pyrimidin-4-amine
CID 80823280
1-[6-(ethylamino)-5-methylpyrimidin-4-yl]-4-methylpiperidin-3-ol
CID 102971284
5-chloro-6-(2-ethylmorpholin-4-yl)pyrimidin-4-amine
CID 106811779
6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80854935
(2R)-2-ethyl-4-(7H-purin-6-yl)morpholine
CID 94145887
N-ethyl-3-[2-(methoxymethyl)morpholin-4-yl]pyrazin-2-amine
CID 122142070
N-ethyl-5-methyl-6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 80793772
6-(3,3-dimethylpiperidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80835406
N-ethyl-6-(5-ethyl-2-methylmorpholin-4-yl)-5-methylpyrimidin-4-amine
CID 80796209
6-(8-azaspiro[4.5]decan-8-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80831776
6-(3,3-diethylpyrrolidin-1-yl)-N-ethyl-5-methylpyrimidin-4-amine
CID 80855240

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine?
The IUPAC name of N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine (CID 80788166) is N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine is CCNc1ncnc(N2CCOC(CC)C2)c1C.
What is the InChIKey of N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine?
The InChIKey is XIWOARQISUVSSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-4-11-8-17(6-7-18-11)13-10(3)12(14-5-2)15-9-16-13/h9,11H,4-8H2,1-3H3,(H,14,15,16).
What are the key properties of N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine?
N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine has a molecular weight of 250.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(2-ethylmorpholin-4-yl)-5-methylpyrimidin-4-amine is sourced from PubChem (CID 80788166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).