methanol;2-methylpyrrolidine

C6H15NO — CID 143067614

IUPACmethanol;2-methylpyrrolidine
SMILESCC1CCCN1.CO
InChIInChI=1S/C5H11N.CH4O/c1-5-3-2-4-6-5;1-2/h5-6H,2-4H2,1H3;2H,1H3
InChIKeyGPIHAYYKQVIWDH-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.37
Rot. Bonds

About methanol;2-methylpyrrolidine

methanol;2-methylpyrrolidine (PubChem CID 143067614) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is methanol;2-methylpyrrolidine.

Molecular Properties

Compound Namemethanol;2-methylpyrrolidine
PubChem CID143067614
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Namemethanol;2-methylpyrrolidine
SMILESCC1CCCN1.CO
InChIInChI=1S/C5H11N.CH4O/c1-5-3-2-4-6-5;1-2/h5-6H,2-4H2,1H3;2H,1H3
InChIKeyGPIHAYYKQVIWDH-UHFFFAOYSA-N
XLogP0.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methanol;2-methylpyrrolidine?
The IUPAC name of methanol;2-methylpyrrolidine (CID 143067614) is methanol;2-methylpyrrolidine.
What is the SMILES notation for methanol;2-methylpyrrolidine?
The canonical SMILES for methanol;2-methylpyrrolidine is CC1CCCN1.CO.
What is the InChIKey of methanol;2-methylpyrrolidine?
The InChIKey is GPIHAYYKQVIWDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.CH4O/c1-5-3-2-4-6-5;1-2/h5-6H,2-4H2,1H3;2H,1H3.
What are the key properties of methanol;2-methylpyrrolidine?
methanol;2-methylpyrrolidine has a molecular weight of 117.19 g/mol, XLogP of 0.37, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;2-methylpyrrolidine is sourced from PubChem (CID 143067614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).