6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine

C14H24N4 — CID 80933757

IUPAC6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1nc(NC)cc(N2CC(C)CC(C)C2)n1
InChIInChI=1S/C14H24N4/c1-5-12-16-13(15-4)7-14(17-12)18-8-10(2)6-11(3)9-18/h7,10-11H,5-6,8-9H2,1-4H3,(H,15,16,17)
InChIKeySEOVFLAMKFQFBR-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.56
Rot. Bonds3

About 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine

6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine (PubChem CID 80933757) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine
PubChem CID80933757
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine
SMILESCCc1nc(NC)cc(N2CC(C)CC(C)C2)n1
InChIInChI=1S/C14H24N4/c1-5-12-16-13(15-4)7-14(17-12)18-8-10(2)6-11(3)9-18/h7,10-11H,5-6,8-9H2,1-4H3,(H,15,16,17)
InChIKeySEOVFLAMKFQFBR-UHFFFAOYSA-N
XLogP2.56
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine?
The IUPAC name of 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine (CID 80933757) is 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine is CCc1nc(NC)cc(N2CC(C)CC(C)C2)n1.
What is the InChIKey of 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine?
The InChIKey is SEOVFLAMKFQFBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-5-12-16-13(15-4)7-14(17-12)18-8-10(2)6-11(3)9-18/h7,10-11H,5-6,8-9H2,1-4H3,(H,15,16,17).
What are the key properties of 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine?
6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine has a molecular weight of 248.37 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylpiperidin-1-yl)-2-ethyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 80933757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).