5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine

C13H22N4 — CID 62190547

IUPAC5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine
SMILESCCc1c(C)nc(N2CCCCC2)nc1NC
InChIInChI=1S/C13H22N4/c1-4-11-10(2)15-13(16-12(11)14-3)17-8-6-5-7-9-17/h4-9H2,1-3H3,(H,14,15,16)
InChIKeyCFOOGZRXECSJCD-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.38
Rot. Bonds3

About 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine

5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine (PubChem CID 62190547) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine
PubChem CID62190547
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine
SMILESCCc1c(C)nc(N2CCCCC2)nc1NC
InChIInChI=1S/C13H22N4/c1-4-11-10(2)15-13(16-12(11)14-3)17-8-6-5-7-9-17/h4-9H2,1-3H3,(H,14,15,16)
InChIKeyCFOOGZRXECSJCD-UHFFFAOYSA-N
XLogP2.38
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine (CID 62190547) is 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine is CCc1c(C)nc(N2CCCCC2)nc1NC.
What is the InChIKey of 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine?
The InChIKey is CFOOGZRXECSJCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-4-11-10(2)15-13(16-12(11)14-3)17-8-6-5-7-9-17/h4-9H2,1-3H3,(H,14,15,16).
What are the key properties of 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine?
5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine has a molecular weight of 234.35 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N,6-dimethyl-2-piperidin-1-ylpyrimidin-4-amine is sourced from PubChem (CID 62190547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).