3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one

C14H26N4O — CID 55156417

IUPAC3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one
SMILESCC(C)Cn1ccnc(NCC(C)(C)N(C)C)c1=O
InChIInChI=1S/C14H26N4O/c1-11(2)9-18-8-7-15-12(13(18)19)16-10-14(3,4)17(5)6/h7-8,11H,9-10H2,1-6H3,(H,15,16)
InChIKeyGMHQARAEIRMDFS-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.65
Rot. Bonds6

About 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one

3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one (PubChem CID 55156417) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one.

Molecular Properties

Compound Name3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one
PubChem CID55156417
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one
SMILESCC(C)Cn1ccnc(NCC(C)(C)N(C)C)c1=O
InChIInChI=1S/C14H26N4O/c1-11(2)9-18-8-7-15-12(13(18)19)16-10-14(3,4)17(5)6/h7-8,11H,9-10H2,1-6H3,(H,15,16)
InChIKeyGMHQARAEIRMDFS-UHFFFAOYSA-N
XLogP1.65
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one
CID 62939654
3-[2-(dimethylamino)propylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 62938830
3-[2-(methylamino)ethylamino]-1-(2-methylpropyl)pyrazin-2-one
CID 62927277
3-(7-methyloctylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 107816214
3-[(3-hydroxy-2,3-dimethylbutan-2-yl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 106185827
1-(2-methylpropyl)-3-(pentylamino)pyrazin-2-one
CID 62940519
3-[[2-methyl-3-(methylamino)propyl]amino]-1-(2-methylpropyl)pyrazin-2-one
CID 113282618
3-[(3-chloro-2-methylpropyl)amino]-1-(2-methylpropyl)pyrazin-2-one
CID 65037499
3-(cyclopropylmethylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 62938956
3-(butan-2-ylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 62939478
1-(2-methylpropyl)-3-[(2-oxo-2-pyrrolidin-1-ylethyl)amino]pyrazin-2-one
CID 115765269
3-(2-cyclobutylethylamino)-1-(2-methylpropyl)pyrazin-2-one
CID 115883841

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one?
The IUPAC name of 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one (CID 55156417) is 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one.
What is the SMILES notation for 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one?
The canonical SMILES for 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one is CC(C)Cn1ccnc(NCC(C)(C)N(C)C)c1=O.
What is the InChIKey of 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one?
The InChIKey is GMHQARAEIRMDFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-11(2)9-18-8-7-15-12(13(18)19)16-10-14(3,4)17(5)6/h7-8,11H,9-10H2,1-6H3,(H,15,16).
What are the key properties of 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one?
3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one has a molecular weight of 266.39 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(dimethylamino)-2-methylpropyl]amino]-1-(2-methylpropyl)pyrazin-2-one is sourced from PubChem (CID 55156417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).