2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine

C16H20N4 — CID 121275152

IUPAC2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine
SMILESCc1ncc(CN2CCC(c3ccccn3)CC2)cn1
InChIInChI=1S/C16H20N4/c1-13-18-10-14(11-19-13)12-20-8-5-15(6-9-20)16-4-2-3-7-17-16/h2-4,7,10-11,15H,5-6,8-9,12H2,1H3
InChIKeyOQVPLTZLLVCQHG-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.56
Rot. Bonds3

About 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine

2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine (PubChem CID 121275152) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine.

Molecular Properties

Compound Name2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine
PubChem CID121275152
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC Name2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine
SMILESCc1ncc(CN2CCC(c3ccccn3)CC2)cn1
InChIInChI=1S/C16H20N4/c1-13-18-10-14(11-19-13)12-20-8-5-15(6-9-20)16-4-2-3-7-17-16/h2-4,7,10-11,15H,5-6,8-9,12H2,1H3
InChIKeyOQVPLTZLLVCQHG-UHFFFAOYSA-N
XLogP2.56
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-5-[[4-(6-methylpyrazin-2-yl)piperidin-1-yl]methyl]pyrimidine
CID 118739889
N-methyl-4-[(4-pyridin-2-ylpiperidin-1-yl)methyl]benzamide
CID 136517634
6-cyclopropyl-3-[1-[(2-methylpyrimidin-5-yl)methyl]piperidin-4-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 126911035
2-methyl-5-[[(3R)-3-(1H-pyrazol-5-yl)pyrrolidin-1-yl]methyl]pyrimidine
CID 124963845
ethane;3-(4-pyridin-2-ylpiperidin-1-yl)propan-1-amine
CID 91234805
2-[(4-pyridin-2-ylpiperidin-1-yl)methyl]-[1,3]thiazolo[5,4-b]pyridine
CID 10425517
2-methyl-5-[(3-pyrazol-1-ylpyrrolidin-1-yl)methyl]pyrimidine
CID 126946539
2-[(2-methylpyrimidin-5-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 140988917
5-[[(3R)-3-methoxypyrrolidin-1-yl]methyl]-2-pyridin-2-ylpyrimidine
CID 99950359
2-[1-[(2-methylpyrimidin-5-yl)methyl]pyrrolidin-3-yl]propan-2-ol
CID 131889268
6-(1-benzylpiperidin-4-yl)-N-pyrimidin-2-ylpyrazin-2-amine
CID 155983124
2-[(2-methylphenyl)methyl]-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine
CID 95809282

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine?
The IUPAC name of 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine (CID 121275152) is 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine.
What is the SMILES notation for 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine?
The canonical SMILES for 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine is Cc1ncc(CN2CCC(c3ccccn3)CC2)cn1.
What is the InChIKey of 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine?
The InChIKey is OQVPLTZLLVCQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-13-18-10-14(11-19-13)12-20-8-5-15(6-9-20)16-4-2-3-7-17-16/h2-4,7,10-11,15H,5-6,8-9,12H2,1H3.
What are the key properties of 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine?
2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine has a molecular weight of 268.36 g/mol, XLogP of 2.56, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[(4-pyridin-2-ylpiperidin-1-yl)methyl]pyrimidine is sourced from PubChem (CID 121275152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).