4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine

C13H21N3 — CID 83849476

IUPAC4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine
SMILESCCc1ncnc(CC2CCCCN2)c1C
InChIInChI=1S/C13H21N3/c1-3-12-10(2)13(16-9-15-12)8-11-6-4-5-7-14-11/h9,11,14H,3-8H2,1-2H3
InChIKeyCPZBGEFHMKJTCW-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.03
Rot. Bonds3

About 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine

4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine (PubChem CID 83849476) has the molecular formula C13H21N3 and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine.

Molecular Properties

Compound Name4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine
PubChem CID83849476
Molecular FormulaC13H21N3
Molecular Weight219.33 g/mol
Exact Mass219.17
IUPAC Name4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine
SMILESCCc1ncnc(CC2CCCCN2)c1C
InChIInChI=1S/C13H21N3/c1-3-12-10(2)13(16-9-15-12)8-11-6-4-5-7-14-11/h9,11,14H,3-8H2,1-2H3
InChIKeyCPZBGEFHMKJTCW-UHFFFAOYSA-N
XLogP2.03
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-2-(piperidin-2-ylmethyl)pyridine
CID 4715233
4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 105462178
4-(pyrrolidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 83848148
3,6,7,8-tetramethyl-2-[[(2S)-piperidin-2-yl]methyl]imidazo[1,2-a]pyridine
CID 58477959
5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 84657560
(2R)-2-[(4-methylphenyl)methyl]piperidine
CID 7048103
4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 62542496
4-ethyl-2-(piperidin-2-ylmethyl)-4,5-dihydro-1,3-oxazole
CID 84667116
5-ethoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231619
4-methyl-5-(piperidin-2-ylmethyl)-1,2-dihydropyrazol-3-one
CID 83856954
3-(piperidin-2-ylmethyl)-1,2-benzoxazol-7-ol
CID 84695678
2-[(2,3-dimethyl-5-methylsulfanylphenyl)methyl]pyrrolidine
CID 117343801

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine?
The IUPAC name of 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine (CID 83849476) is 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine.
What is the SMILES notation for 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine?
The canonical SMILES for 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine is CCc1ncnc(CC2CCCCN2)c1C.
What is the InChIKey of 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine?
The InChIKey is CPZBGEFHMKJTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3/c1-3-12-10(2)13(16-9-15-12)8-11-6-4-5-7-14-11/h9,11,14H,3-8H2,1-2H3.
What are the key properties of 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine?
4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine has a molecular weight of 219.33 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine is sourced from PubChem (CID 83849476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).