4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine

C15H25N3O — CID 133460751

IUPAC4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine
SMILESCCOCC1CCN(c2cc(CC)nc(C)n2)CC1
InChIInChI=1S/C15H25N3O/c1-4-14-10-15(17-12(3)16-14)18-8-6-13(7-9-18)11-19-5-2/h10,13H,4-9,11H2,1-3H3
InChIKeySHMJTEWBLHLOTJ-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.60
Rot. Bonds5

About 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine

4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine (PubChem CID 133460751) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine.

Molecular Properties

Compound Name4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine
PubChem CID133460751
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine
SMILESCCOCC1CCN(c2cc(CC)nc(C)n2)CC1
InChIInChI=1S/C15H25N3O/c1-4-14-10-15(17-12(3)16-14)18-8-6-13(7-9-18)11-19-5-2/h10,13H,4-9,11H2,1-3H3
InChIKeySHMJTEWBLHLOTJ-UHFFFAOYSA-N
XLogP2.60
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-6-[(3S)-3-(ethoxymethyl)pyrrolidin-1-yl]-2-methylpyrimidine
CID 129471026
2-[1-(6-ethyl-2-methylpyrimidin-4-yl)piperidin-4-yl]-N-methylacetamide
CID 133461511
4-[4-(methoxymethyl)piperidin-1-yl]-2,6-dimethylpyrimidine
CID 66801525
(3R)-1-(6-ethyl-2-methylpyrimidin-4-yl)pyrrolidine-3-carboxylic acid
CID 97055767
4-[4-(2-ethoxyethyl)-3-methylpiperazin-1-yl]-6-ethyl-2-methylpyrimidine
CID 133460422
4-(2,5-dimethylpyrrolidin-1-yl)-6-ethyl-2-methylpyrimidine
CID 133472422
1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidin-4-amine
CID 66332707
4-ethyl-2-methyl-6-[4-(5-methylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
CID 154882608
4-benzyl-1-(6-ethyl-2-methylpyrimidin-4-yl)-5-methyl-1,4-diazepane
CID 133461463
[6-[4-(methoxymethyl)piperidin-1-yl]-2-methylpyrimidin-4-yl]hydrazine
CID 80911487
4-[1-(6-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine
CID 133461297
1-(6-ethyl-2-methylpyrimidin-4-yl)-N-(3-methoxyphenyl)piperidin-4-amine
CID 133460647

Frequently Asked Questions

What is the IUPAC name of 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine?
The IUPAC name of 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine (CID 133460751) is 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine.
What is the SMILES notation for 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine?
The canonical SMILES for 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine is CCOCC1CCN(c2cc(CC)nc(C)n2)CC1.
What is the InChIKey of 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine?
The InChIKey is SHMJTEWBLHLOTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-4-14-10-15(17-12(3)16-14)18-8-6-13(7-9-18)11-19-5-2/h10,13H,4-9,11H2,1-3H3.
What are the key properties of 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine?
4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine has a molecular weight of 263.38 g/mol, XLogP of 2.60, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(ethoxymethyl)piperidin-1-yl]-6-ethyl-2-methylpyrimidine is sourced from PubChem (CID 133460751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).