4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine

C14H23N3 — CID 116893407

IUPAC4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine
SMILESCc1cc(CC(C)C)nc(C2CCCCN2)n1
InChIInChI=1S/C14H23N3/c1-10(2)8-12-9-11(3)16-14(17-12)13-6-4-5-7-15-13/h9-10,13,15H,4-8H2,1-3H3
InChIKeyXXOHBEUMVDIBDK-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.80
Rot. Bonds3

About 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine

4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine (PubChem CID 116893407) has the molecular formula C14H23N3 and a molecular weight of 233.36 g/mol. Its IUPAC name is 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine.

Molecular Properties

Compound Name4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine
PubChem CID116893407
Molecular FormulaC14H23N3
Molecular Weight233.36 g/mol
Exact Mass233.19
IUPAC Name4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine
SMILESCc1cc(CC(C)C)nc(C2CCCCN2)n1
InChIInChI=1S/C14H23N3/c1-10(2)8-12-9-11(3)16-14(17-12)13-6-4-5-7-15-13/h9-10,13,15H,4-8H2,1-3H3
InChIKeyXXOHBEUMVDIBDK-UHFFFAOYSA-N
XLogP2.80
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-cyclohexyl-6-methyl-2-pyrrolidin-2-ylpyrimidine
CID 63319069
4-[4-methyl-6-(2-methylpropyl)pyrimidin-2-yl]cyclohexan-1-one
CID 116895673
3-[4-methyl-6-(2-methylpropyl)pyrimidin-2-yl]cyclobutan-1-amine
CID 116893625
4-methyl-6-(2-methylpropyl)-2-(piperidin-4-ylmethyl)pyrimidine
CID 116893542
3-(azepan-2-yl)-5-(2-methylpropyl)-1,2,4-oxadiazole
CID 84688673
4-methyl-2-[(2R)-piperidin-2-yl]-6-(2-propylpyrazol-3-yl)pyrimidine
CID 124964353
4-methyl-6-phenoxy-2-[(2S)-piperidin-2-yl]pyrimidine
CID 124938852
4-methyl-6-(2-methylphenyl)-2-pyrrolidin-2-ylpyrimidine
CID 116893348
6-methyl-2-piperidin-2-yl-N-pyrazin-2-ylpyrimidin-4-amine
CID 175660444
5-methyl-2-(6-methyl-2-pyrrolidin-2-ylpyrimidin-4-yl)-1,3-thiazole
CID 110100411
6-[(dimethylamino)methyl]-N-methyl-2-piperidin-2-ylpyrimidin-4-amine
CID 66509772
4-cyclopropyl-2-piperidin-2-yl-6-propan-2-ylpyrimidine
CID 63319142

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine?
The IUPAC name of 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine (CID 116893407) is 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine.
What is the SMILES notation for 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine?
The canonical SMILES for 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine is Cc1cc(CC(C)C)nc(C2CCCCN2)n1.
What is the InChIKey of 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine?
The InChIKey is XXOHBEUMVDIBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3/c1-10(2)8-12-9-11(3)16-14(17-12)13-6-4-5-7-15-13/h9-10,13,15H,4-8H2,1-3H3.
What are the key properties of 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine?
4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine has a molecular weight of 233.36 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine is sourced from PubChem (CID 116893407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).