bis(dimethylamino) carbonate

C5H12N2O3 — CID 87610786

IUPACbis(dimethylamino) carbonate
SMILESCN(C)OC(=O)ON(C)C
InChIInChI=1S/C5H12N2O3/c1-6(2)9-5(8)10-7(3)4/h1-4H3
InChIKeyMAWACOUPGOXJSZ-UHFFFAOYSA-N
MW148.16 g/mol
LogP0.09
Rot. Bonds2

About bis(dimethylamino) carbonate

bis(dimethylamino) carbonate (PubChem CID 87610786) has the molecular formula C5H12N2O3 and a molecular weight of 148.16 g/mol. Its IUPAC name is bis(dimethylamino) carbonate.

Molecular Properties

Compound Namebis(dimethylamino) carbonate
PubChem CID87610786
Molecular FormulaC5H12N2O3
Molecular Weight148.16 g/mol
Exact Mass148.08
IUPAC Namebis(dimethylamino) carbonate
SMILESCN(C)OC(=O)ON(C)C
InChIInChI=1S/C5H12N2O3/c1-6(2)9-5(8)10-7(3)4/h1-4H3
InChIKeyMAWACOUPGOXJSZ-UHFFFAOYSA-N
XLogP0.09
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 50.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

dimethylamino 2-methylpropanoate;hydrochloride
CID 90220610
dimethylamino prop-2-enoate
CID 20697927
azane;dimethylamino prop-2-enoate
CID 162313992
dimethylamino cyclopropanecarboxylate
CID 87328371
chloromethane;dimethylamino 2-methylprop-2-enoate
CID 172778476
chloromethane;dimethylamino (E)-2-methylbut-2-enoate
CID 88606182
[carboxyoxy(methyl)amino] hydrogen carbonate
CID 23295715
dimethylamino (E)-2-ethylbut-2-enoate
CID 158766870
lithium;dimethylamino 2-[di(propan-2-yl)amino]acetate;hydride
CID 174567234
dimethylamino pentadecanoate
CID 57147620
dimethylamino 4-chloro-2,3-dimethylbut-2-enoate
CID 57124176
dimethylamino 2-methylidenepentanoate
CID 19885812

Frequently Asked Questions

What is the IUPAC name of bis(dimethylamino) carbonate?
The IUPAC name of bis(dimethylamino) carbonate (CID 87610786) is bis(dimethylamino) carbonate.
What is the SMILES notation for bis(dimethylamino) carbonate?
The canonical SMILES for bis(dimethylamino) carbonate is CN(C)OC(=O)ON(C)C.
What is the InChIKey of bis(dimethylamino) carbonate?
The InChIKey is MAWACOUPGOXJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O3/c1-6(2)9-5(8)10-7(3)4/h1-4H3.
What are the key properties of bis(dimethylamino) carbonate?
bis(dimethylamino) carbonate has a molecular weight of 148.16 g/mol, XLogP of 0.09, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dimethylamino) carbonate is sourced from PubChem (CID 87610786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).