ethane;2-(methylamino)acetamide;toluene

C12H22N2O — CID 143083884

IUPACethane;2-(methylamino)acetamide;toluene
SMILESCC.CNCC(N)=O.Cc1ccccc1
InChIInChI=1S/C7H8.C3H8N2O.C2H6/c1-7-5-3-2-4-6-7;1-5-2-3(4)6;1-2/h2-6H,1H3;5H,2H2,1H3,(H2,4,6);1-2H3
InChIKeyAGHRZAOEKGJMEX-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.71
Rot. Bonds2

About ethane;2-(methylamino)acetamide;toluene

ethane;2-(methylamino)acetamide;toluene (PubChem CID 143083884) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is ethane;2-(methylamino)acetamide;toluene.

Molecular Properties

Compound Nameethane;2-(methylamino)acetamide;toluene
PubChem CID143083884
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Nameethane;2-(methylamino)acetamide;toluene
SMILESCC.CNCC(N)=O.Cc1ccccc1
InChIInChI=1S/C7H8.C3H8N2O.C2H6/c1-7-5-3-2-4-6-7;1-5-2-3(4)6;1-2/h2-6H,1H3;5H,2H2,1H3,(H2,4,6);1-2H3
InChIKeyAGHRZAOEKGJMEX-UHFFFAOYSA-N
XLogP1.71
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;2-(methylamino)acetamide;toluene?
The IUPAC name of ethane;2-(methylamino)acetamide;toluene (CID 143083884) is ethane;2-(methylamino)acetamide;toluene.
What is the SMILES notation for ethane;2-(methylamino)acetamide;toluene?
The canonical SMILES for ethane;2-(methylamino)acetamide;toluene is CC.CNCC(N)=O.Cc1ccccc1.
What is the InChIKey of ethane;2-(methylamino)acetamide;toluene?
The InChIKey is AGHRZAOEKGJMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.C3H8N2O.C2H6/c1-7-5-3-2-4-6-7;1-5-2-3(4)6;1-2/h2-6H,1H3;5H,2H2,1H3,(H2,4,6);1-2H3.
What are the key properties of ethane;2-(methylamino)acetamide;toluene?
ethane;2-(methylamino)acetamide;toluene has a molecular weight of 210.32 g/mol, XLogP of 1.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(methylamino)acetamide;toluene is sourced from PubChem (CID 143083884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).