6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine

C18H24N4 — CID 56766967

IUPAC6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine
SMILESCCc1cc(NC2CCNCC2)nc(-c2ccc(C)cc2)n1
InChIInChI=1S/C18H24N4/c1-3-15-12-17(20-16-8-10-19-11-9-16)22-18(21-15)14-6-4-13(2)5-7-14/h4-7,12,16,19H,3,8-11H2,1-2H3,(H,20,21,22)
InChIKeyHWCCYQJFABHQBW-UHFFFAOYSA-N
MW296.42 g/mol
LogP3.18
Rot. Bonds4

About 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine

6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine (PubChem CID 56766967) has the molecular formula C18H24N4 and a molecular weight of 296.42 g/mol. Its IUPAC name is 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine
PubChem CID56766967
Molecular FormulaC18H24N4
Molecular Weight296.42 g/mol
Exact Mass296.20
IUPAC Name6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine
SMILESCCc1cc(NC2CCNCC2)nc(-c2ccc(C)cc2)n1
InChIInChI=1S/C18H24N4/c1-3-15-12-17(20-16-8-10-19-11-9-16)22-18(21-15)14-6-4-13(2)5-7-14/h4-7,12,16,19H,3,8-11H2,1-2H3,(H,20,21,22)
InChIKeyHWCCYQJFABHQBW-UHFFFAOYSA-N
XLogP3.18
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxyphenyl)-N-piperidin-4-yl-6-propylpyrimidin-4-amine
CID 56766998
2-(3,5-dimethylpyrazol-1-yl)-6-ethyl-N-piperidin-4-ylpyrimidin-4-amine
CID 71564132
2-ethyl-6-methyl-N-piperidin-4-ylpyrimidin-4-amine
CID 94075343
2-(4-methylphenyl)-N-(piperidin-3-ylmethyl)-6-propylpyrimidin-4-amine
CID 56768328
6-ethyl-N-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]-2-pyridin-4-ylpyrimidin-4-amine
CID 133358047
4-N-(6-ethyl-2-methylpyrimidin-4-yl)-1-N-methylcyclohexane-1,4-diamine
CID 79110713
6-methyl-N-piperidin-4-yl-2-pyridin-3-ylpyrimidin-4-amine
CID 94075322
6-ethyl-2-(2-fluorophenyl)-N-(piperidin-4-ylmethyl)pyrimidin-4-amine
CID 56768131
2-phenyl-N-piperidin-3-yl-6-propylpyrimidin-4-amine
CID 56768428
2-N-ethyl-6-methyl-4-N-piperidin-4-ylpyrimidine-2,4-diamine
CID 142401938
[4-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 133472420
2-ethyl-6-phenyl-N-piperidin-4-ylpyrimidin-4-amine
CID 56767062

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine (CID 56766967) is 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine is CCc1cc(NC2CCNCC2)nc(-c2ccc(C)cc2)n1.
What is the InChIKey of 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine?
The InChIKey is HWCCYQJFABHQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4/c1-3-15-12-17(20-16-8-10-19-11-9-16)22-18(21-15)14-6-4-13(2)5-7-14/h4-7,12,16,19H,3,8-11H2,1-2H3,(H,20,21,22).
What are the key properties of 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine?
6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine has a molecular weight of 296.42 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(4-methylphenyl)-N-piperidin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 56766967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).