ethane;methanol;2-(methylamino)acetamide;toluene

C13H26N2O2 — CID 176999193

IUPACethane;methanol;2-(methylamino)acetamide;toluene
SMILESCC.CNCC(N)=O.CO.Cc1ccccc1
InChIInChI=1S/C7H8.C3H8N2O.C2H6.CH4O/c1-7-5-3-2-4-6-7;1-5-2-3(4)6;2*1-2/h2-6H,1H3;5H,2H2,1H3,(H2,4,6);1-2H3;2H,1H3
InChIKeyKYASZAWBRHEWFR-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.32
Rot. Bonds2

About ethane;methanol;2-(methylamino)acetamide;toluene

ethane;methanol;2-(methylamino)acetamide;toluene (PubChem CID 176999193) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is ethane;methanol;2-(methylamino)acetamide;toluene.

Molecular Properties

Compound Nameethane;methanol;2-(methylamino)acetamide;toluene
PubChem CID176999193
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Nameethane;methanol;2-(methylamino)acetamide;toluene
SMILESCC.CNCC(N)=O.CO.Cc1ccccc1
InChIInChI=1S/C7H8.C3H8N2O.C2H6.CH4O/c1-7-5-3-2-4-6-7;1-5-2-3(4)6;2*1-2/h2-6H,1H3;5H,2H2,1H3,(H2,4,6);1-2H3;2H,1H3
InChIKeyKYASZAWBRHEWFR-UHFFFAOYSA-N
XLogP1.32
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;methanol;2-(methylamino)acetamide;toluene?
The IUPAC name of ethane;methanol;2-(methylamino)acetamide;toluene (CID 176999193) is ethane;methanol;2-(methylamino)acetamide;toluene.
What is the SMILES notation for ethane;methanol;2-(methylamino)acetamide;toluene?
The canonical SMILES for ethane;methanol;2-(methylamino)acetamide;toluene is CC.CNCC(N)=O.CO.Cc1ccccc1.
What is the InChIKey of ethane;methanol;2-(methylamino)acetamide;toluene?
The InChIKey is KYASZAWBRHEWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.C3H8N2O.C2H6.CH4O/c1-7-5-3-2-4-6-7;1-5-2-3(4)6;2*1-2/h2-6H,1H3;5H,2H2,1H3,(H2,4,6);1-2H3;2H,1H3.
What are the key properties of ethane;methanol;2-(methylamino)acetamide;toluene?
ethane;methanol;2-(methylamino)acetamide;toluene has a molecular weight of 242.36 g/mol, XLogP of 1.32, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methanol;2-(methylamino)acetamide;toluene is sourced from PubChem (CID 176999193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).