methoxymethane;pyrrol-2-one

C6H9NO2 — CID 68539286

IUPACmethoxymethane;pyrrol-2-one
SMILESCOC.O=C1C=CC=N1
InChIInChI=1S/C4H3NO.C2H6O/c6-4-2-1-3-5-4;1-3-2/h1-3H;1-2H3
InChIKeyBLHHFLGGDAJLHX-UHFFFAOYSA-N
MW127.14 g/mol
LogP0.42
Rot. Bonds

About methoxymethane;pyrrol-2-one

methoxymethane;pyrrol-2-one (PubChem CID 68539286) has the molecular formula C6H9NO2 and a molecular weight of 127.14 g/mol. Its IUPAC name is methoxymethane;pyrrol-2-one.

Molecular Properties

Compound Namemethoxymethane;pyrrol-2-one
PubChem CID68539286
Molecular FormulaC6H9NO2
Molecular Weight127.14 g/mol
Exact Mass127.06
IUPAC Namemethoxymethane;pyrrol-2-one
SMILESCOC.O=C1C=CC=N1
InChIInChI=1S/C4H3NO.C2H6O/c6-4-2-1-3-5-4;1-3-2/h1-3H;1-2H3
InChIKeyBLHHFLGGDAJLHX-UHFFFAOYSA-N
XLogP0.42
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.14
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methoxymethane;pyrrol-2-one?
The IUPAC name of methoxymethane;pyrrol-2-one (CID 68539286) is methoxymethane;pyrrol-2-one.
What is the SMILES notation for methoxymethane;pyrrol-2-one?
The canonical SMILES for methoxymethane;pyrrol-2-one is COC.O=C1C=CC=N1.
What is the InChIKey of methoxymethane;pyrrol-2-one?
The InChIKey is BLHHFLGGDAJLHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3NO.C2H6O/c6-4-2-1-3-5-4;1-3-2/h1-3H;1-2H3.
What are the key properties of methoxymethane;pyrrol-2-one?
methoxymethane;pyrrol-2-one has a molecular weight of 127.14 g/mol, XLogP of 0.42, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;pyrrol-2-one is sourced from PubChem (CID 68539286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).