5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine

C14H24N4O — CID 107396356

IUPAC5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine
SMILESCCc1c(NC)ncnc1N1CCCC(C)(OC)C1
InChIInChI=1S/C14H24N4O/c1-5-11-12(15-3)16-10-17-13(11)18-8-6-7-14(2,9-18)19-4/h10H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyHEAUCWXSHTUVAL-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.09
Rot. Bonds4

About 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine

5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine (PubChem CID 107396356) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine
PubChem CID107396356
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine
SMILESCCc1c(NC)ncnc1N1CCCC(C)(OC)C1
InChIInChI=1S/C14H24N4O/c1-5-11-12(15-3)16-10-17-13(11)18-8-6-7-14(2,9-18)19-4/h10H,5-9H2,1-4H3,(H,15,16,17)
InChIKeyHEAUCWXSHTUVAL-UHFFFAOYSA-N
XLogP2.09
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine (CID 107396356) is 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine is CCc1c(NC)ncnc1N1CCCC(C)(OC)C1.
What is the InChIKey of 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
The InChIKey is HEAUCWXSHTUVAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-11-12(15-3)16-10-17-13(11)18-8-6-7-14(2,9-18)19-4/h10H,5-9H2,1-4H3,(H,15,16,17).
What are the key properties of 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine?
5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine has a molecular weight of 264.37 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-(3-methoxy-3-methylpiperidin-1-yl)-N-methylpyrimidin-4-amine is sourced from PubChem (CID 107396356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).