[6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone

C15H24N4O2 — CID 109365564

IUPAC[6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone
SMILESCCCCN(C)c1cc(C(=O)N2CCOCC2)nc(C)n1
InChIInChI=1S/C15H24N4O2/c1-4-5-6-18(3)14-11-13(16-12(2)17-14)15(20)19-7-9-21-10-8-19/h11H,4-10H2,1-3H3
InChIKeySDKPYANHKVMVEF-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.49
Rot. Bonds5

About [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone

[6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 109365564) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone
PubChem CID109365564
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name[6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone
SMILESCCCCN(C)c1cc(C(=O)N2CCOCC2)nc(C)n1
InChIInChI=1S/C15H24N4O2/c1-4-5-6-18(3)14-11-13(16-12(2)17-14)15(20)19-7-9-21-10-8-19/h11H,4-10H2,1-3H3
InChIKeySDKPYANHKVMVEF-UHFFFAOYSA-N
XLogP1.49
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone (CID 109365564) is [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone is CCCCN(C)c1cc(C(=O)N2CCOCC2)nc(C)n1.
What is the InChIKey of [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is SDKPYANHKVMVEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-5-6-18(3)14-11-13(16-12(2)17-14)15(20)19-7-9-21-10-8-19/h11H,4-10H2,1-3H3.
What are the key properties of [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone?
[6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 292.38 g/mol, XLogP of 1.49, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[butyl(methyl)amino]-2-methylpyrimidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 109365564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).