[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone

C15H24N4O2 — CID 62173078

IUPAC[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone
SMILESCCNc1cnc(C(C)C)nc1C(=O)N1CCOC(C)C1
InChIInChI=1S/C15H24N4O2/c1-5-16-12-8-17-14(10(2)3)18-13(12)15(20)19-6-7-21-11(4)9-19/h8,10-11,16H,5-7,9H2,1-4H3
InChIKeyWXMCXOGSKPDAIH-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.89
Rot. Bonds4

About [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone

[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone (PubChem CID 62173078) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone
PubChem CID62173078
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone
SMILESCCNc1cnc(C(C)C)nc1C(=O)N1CCOC(C)C1
InChIInChI=1S/C15H24N4O2/c1-5-16-12-8-17-14(10(2)3)18-13(12)15(20)19-6-7-21-11(4)9-19/h8,10-11,16H,5-7,9H2,1-4H3
InChIKeyWXMCXOGSKPDAIH-UHFFFAOYSA-N
XLogP1.89
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone?
The IUPAC name of [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone (CID 62173078) is [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone.
What is the SMILES notation for [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone?
The canonical SMILES for [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone is CCNc1cnc(C(C)C)nc1C(=O)N1CCOC(C)C1.
What is the InChIKey of [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone?
The InChIKey is WXMCXOGSKPDAIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-5-16-12-8-17-14(10(2)3)18-13(12)15(20)19-6-7-21-11(4)9-19/h8,10-11,16H,5-7,9H2,1-4H3.
What are the key properties of [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone?
[5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone has a molecular weight of 292.38 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(ethylamino)-2-propan-2-ylpyrimidin-4-yl]-(2-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 62173078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).