[2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone

C16H26N4O — CID 109323152

IUPAC[2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCCN(CC)c1nc(C)cc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C16H26N4O/c1-5-19(6-2)16-17-13(4)11-14(18-16)15(21)20-9-7-12(3)8-10-20/h11-12H,5-10H2,1-4H3
InChIKeySSGNHIJMRJRSQY-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.50
Rot. Bonds4

About [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone

[2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 109323152) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone
PubChem CID109323152
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name[2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCCN(CC)c1nc(C)cc(C(=O)N2CCC(C)CC2)n1
InChIInChI=1S/C16H26N4O/c1-5-19(6-2)16-17-13(4)11-14(18-16)15(21)20-9-7-12(3)8-10-20/h11-12H,5-10H2,1-4H3
InChIKeySSGNHIJMRJRSQY-UHFFFAOYSA-N
XLogP2.50
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone (CID 109323152) is [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone is CCN(CC)c1nc(C)cc(C(=O)N2CCC(C)CC2)n1.
What is the InChIKey of [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is SSGNHIJMRJRSQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-5-19(6-2)16-17-13(4)11-14(18-16)15(21)20-9-7-12(3)8-10-20/h11-12H,5-10H2,1-4H3.
What are the key properties of [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
[2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 290.41 g/mol, XLogP of 2.50, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(diethylamino)-6-methylpyrimidin-4-yl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 109323152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).