formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one

C11H23NO3 — CID 164907006

IUPACformaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one
SMILESC=O.CCC(=O)N1CCC(C)C1.COC
InChIInChI=1S/C8H15NO.C2H6O.CH2O/c1-3-8(10)9-5-4-7(2)6-9;1-3-2;1-2/h7H,3-6H2,1-2H3;1-2H3;1H2
InChIKeyVTJRMNMAEVEXBK-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.34
Rot. Bonds1

About formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one

formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one (PubChem CID 164907006) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one.

Molecular Properties

Compound Nameformaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one
PubChem CID164907006
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Nameformaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one
SMILESC=O.CCC(=O)N1CCC(C)C1.COC
InChIInChI=1S/C8H15NO.C2H6O.CH2O/c1-3-8(10)9-5-4-7(2)6-9;1-3-2;1-2/h7H,3-6H2,1-2H3;1-2H3;1H2
InChIKeyVTJRMNMAEVEXBK-UHFFFAOYSA-N
XLogP1.34
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one?
The IUPAC name of formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one (CID 164907006) is formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one.
What is the SMILES notation for formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one?
The canonical SMILES for formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one is C=O.CCC(=O)N1CCC(C)C1.COC.
What is the InChIKey of formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one?
The InChIKey is VTJRMNMAEVEXBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.C2H6O.CH2O/c1-3-8(10)9-5-4-7(2)6-9;1-3-2;1-2/h7H,3-6H2,1-2H3;1-2H3;1H2.
What are the key properties of formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one?
formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one has a molecular weight of 217.31 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;methoxymethane;1-(3-methylpyrrolidin-1-yl)propan-1-one is sourced from PubChem (CID 164907006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).