About (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate
(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate (PubChem CID 158845072) has the molecular formula C108H186N30O30
and a molecular weight of 2443.41 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate.
Frequently Asked Questions
What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate?
The IUPAC name of (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate (CID 158845072) is (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate.
What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate?
The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate is CC1[13CH](C(=O)[15NH]CCCC[15NH]C(=O)ON2C(=O)CCC2=O)N([13CH3])[13CH2][13CH]([13CH3])[15N]1[13CH3].C[13CH]1[13CH](C(=O)NCCCCN[13C](=O)ON2C(=O)CCC2=O)[15N]([13CH3])[13CH2][13CH]([13CH3])[15N]1[13CH3].C[13CH]1[13CH](C(=O)[15NH]CCCC[15NH]C(=O)ON2C(=O)CCC2=O)N([13CH3])[13CH2][13CH]([13CH3])[15N]1[13CH3].[13CH3][13CH]1[13CH2]N([13CH3])[13CH](C(=O)NCCCCN[13C](=O)ON2C(=O)CCC2=O)[13CH]([13CH3])[15N]1[13CH3].[13CH3][13CH]1[13CH2]N([13CH3])[13CH](C(=O)[15NH]CCCC[15NH]C(=O)ON2C(=O)CCC2=O)[13CH]([13CH3])N1[13CH3].[13CH3][13CH]1[13CH2][15N]([13CH3])[13CH](C(=O)NCCCCNC(=O)ON2C(=O)CCC2=O)[13CH]([13CH3])[15N]1[13CH3].
What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate?
The InChIKey is IYSJLIJSWCAZDC-YTRCGIMISA-N. The full InChI is InChI=1S/6C18H31N5O5/c6*1-12-11-21(3)16(13(2)22(12)4)17(26)19-9-5-6-10-20-18(27)28-23-14(24)7-8-15(23)25/h6*12-13,16H,5-11H2,1-4H3,(H,19,26)(H,20,27)/i1+1,3+1,4+1,11+1,12+1,13+1,16+1,19+1,20+1,22+1;1+1,3+1,4+1,11+1,12+1,13+1,16+1,18+1,21+1,22+1;1+1,2+1,3+1,4+1,11+1,12+1,13+1,16+1,21+1,22+1;1+1,2+1,3+1,4+1,11+1,12+1,13+1,16+1,19+1,20+1;1+1,2+1,3+1,4+1,11+1,12+1,13+1,16+1,18+1,22+1;1+1,3+1,4+1,11+1,12+1,16+1,19+1,20+1,22+1.
What are the key properties of (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate?
(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate has a molecular weight of 2443.41 g/mol, XLogP of -1.83, 42 rotatable bonds, 12 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[3-methyl-1,4,5-tri((113C)methyl)-(2,5,6-13C3,415N)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4)1,4-diazinane-2-carbonyl](15N)amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,1,4-15N2)1,4-diazinane-2-carbonyl]amino]butyl]carbamate;(2,5-dioxopyrrolidin-1-yl) N-[4-[[1,3,4,5-tetra((113C)methyl)-(2,3,5,6-13C4,415N)1,4-diazinane-2-carbonyl]amino]butyl]carbamate is sourced from PubChem (CID 158845072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).