N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine

C15H26N4O — CID 66332722

IUPACN-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine
SMILESCCNCC1CCCCN1c1cc(OCC)nc(C)n1
InChIInChI=1S/C15H26N4O/c1-4-16-11-13-8-6-7-9-19(13)14-10-15(20-5-2)18-12(3)17-14/h10,13,16H,4-9,11H2,1-3H3
InChIKeyMIIYCRRVHAONNV-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.15
Rot. Bonds6

About N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine

N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine (PubChem CID 66332722) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine
PubChem CID66332722
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine
SMILESCCNCC1CCCCN1c1cc(OCC)nc(C)n1
InChIInChI=1S/C15H26N4O/c1-4-16-11-13-8-6-7-9-19(13)14-10-15(20-5-2)18-12(3)17-14/h10,13,16H,4-9,11H2,1-3H3
InChIKeyMIIYCRRVHAONNV-UHFFFAOYSA-N
XLogP2.15
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[1-(6-ethoxypyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine
CID 66318799
4-[2-(chloromethyl)pyrrolidin-1-yl]-6-ethoxy-2-methylpyrimidine
CID 66331103
4,6-bis(2-ethylpiperidin-1-yl)-2-methylpyrimidine
CID 112876455
N-[[1-(5-methyl-2-pyridinyl)piperidin-2-yl]methyl]ethanamine
CID 62593584
4-[2-(chloromethyl)piperidin-1-yl]-6-methoxy-2-methylpyrimidine
CID 66331673
N-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-2-yl]methyl]propan-2-amine
CID 55218834
N-cyclohexyl-6-(2-ethylpiperidin-1-yl)-2-methylpyrimidin-4-amine
CID 112869044
6-(2-ethylpiperidin-1-yl)-2-methyl-N-propan-2-ylpyrimidin-4-amine
CID 112867342
N-(cyclobutylmethyl)-6-ethoxy-2-methylpyrimidin-4-amine
CID 66326683
N-[[4-(2-methylpyrimidin-4-yl)morpholin-3-yl]methyl]ethanamine
CID 83105196
N-[[1-(6-propoxypyrimidin-4-yl)piperidin-2-yl]methyl]propan-1-amine
CID 66331992
N-[(1-pyrazolo[1,5-a]pyrimidin-5-ylpiperidin-2-yl)methyl]ethanamine
CID 115373034

Frequently Asked Questions

What is the IUPAC name of N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine?
The IUPAC name of N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine (CID 66332722) is N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine is CCNCC1CCCCN1c1cc(OCC)nc(C)n1.
What is the InChIKey of N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine?
The InChIKey is MIIYCRRVHAONNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-4-16-11-13-8-6-7-9-19(13)14-10-15(20-5-2)18-12(3)17-14/h10,13,16H,4-9,11H2,1-3H3.
What are the key properties of N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine?
N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine has a molecular weight of 278.40 g/mol, XLogP of 2.15, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamine is sourced from PubChem (CID 66332722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).