[1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine

C14H24N4O — CID 66327192

IUPAC[1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine
SMILESCCOc1ncnc(N2CCCC(C)C2CN)c1C
InChIInChI=1S/C14H24N4O/c1-4-19-14-11(3)13(16-9-17-14)18-7-5-6-10(2)12(18)8-15/h9-10,12H,4-8,15H2,1-3H3
InChIKeyOWIGATZDEWBMEH-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.75
Rot. Bonds4

About [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine

[1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine (PubChem CID 66327192) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine.

Molecular Properties

Compound Name[1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine
PubChem CID66327192
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine
SMILESCCOc1ncnc(N2CCCC(C)C2CN)c1C
InChIInChI=1S/C14H24N4O/c1-4-19-14-11(3)13(16-9-17-14)18-7-5-6-10(2)12(18)8-15/h9-10,12H,4-8,15H2,1-3H3
InChIKeyOWIGATZDEWBMEH-UHFFFAOYSA-N
XLogP1.75
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(bromomethyl)piperidin-1-yl]-6-ethoxy-5-methylpyrimidine
CID 80675882
[1-(6-ethoxy-5-methylpyrimidin-4-yl)piperidin-4-yl]methanamine
CID 66327389
[1-(6-methoxy-5-methylpyrimidin-4-yl)pyrrolidin-2-yl]methanamine
CID 66331951
[1-(6-methoxypyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine
CID 66317614
1-(6-ethoxy-5-methylpyrimidin-4-yl)-2-methylpyrrolidine-3-carboxylic acid
CID 79369719
[1-(6-methoxy-5-methylpyrimidin-4-yl)azepan-2-yl]methanamine
CID 116640271
[1-(3-bromo-5-methyl-2-pyridinyl)-3-methylpiperidin-2-yl]methanamine
CID 105367345
4-[4-(chloromethyl)piperidin-1-yl]-6-ethoxy-5-methylpyrimidine
CID 66326378
4-(3-chloropyrrolidin-1-yl)-6-ethoxy-5-methylpyrimidine
CID 66326377
1-(6-ethoxy-5-methylpyrimidin-4-yl)-4-methylpyrrolidine-3-carboxylic acid
CID 66325534
[1-(5,6-dimethyl-1,2,4-triazin-3-yl)-3-methylpiperidin-2-yl]methanamine
CID 114787115
4-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-6-ethoxypyrimidin-5-amine
CID 82747186

Frequently Asked Questions

What is the IUPAC name of [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine?
The IUPAC name of [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine (CID 66327192) is [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine.
What is the SMILES notation for [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine?
The canonical SMILES for [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine is CCOc1ncnc(N2CCCC(C)C2CN)c1C.
What is the InChIKey of [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine?
The InChIKey is OWIGATZDEWBMEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-19-14-11(3)13(16-9-17-14)18-7-5-6-10(2)12(18)8-15/h9-10,12H,4-8,15H2,1-3H3.
What are the key properties of [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine?
[1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine has a molecular weight of 264.37 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-ethoxy-5-methylpyrimidin-4-yl)-3-methylpiperidin-2-yl]methanamine is sourced from PubChem (CID 66327192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).