2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride

C7H14ClNO3 — CID 119031719

IUPAC2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride
SMILESCOCC1(C(=O)O)CCCN1.Cl
InChIInChI=1S/C7H13NO3.ClH/c1-11-5-7(6(9)10)3-2-4-8-7;/h8H,2-5H2,1H3,(H,9,10);1H
InChIKeyMEEJSDSHMAEMIH-UHFFFAOYSA-N
MW195.65 g/mol
LogP0.26
Rot. Bonds3

About 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride

2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride (PubChem CID 119031719) has the molecular formula C7H14ClNO3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride
PubChem CID119031719
Molecular FormulaC7H14ClNO3
Molecular Weight195.65 g/mol
Exact Mass195.07
IUPAC Name2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride
SMILESCOCC1(C(=O)O)CCCN1.Cl
InChIInChI=1S/C7H13NO3.ClH/c1-11-5-7(6(9)10)3-2-4-8-7;/h8H,2-5H2,1H3,(H,9,10);1H
InChIKeyMEEJSDSHMAEMIH-UHFFFAOYSA-N
XLogP0.26
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride?
The IUPAC name of 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride (CID 119031719) is 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride.
What is the SMILES notation for 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride?
The canonical SMILES for 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride is COCC1(C(=O)O)CCCN1.Cl.
What is the InChIKey of 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride?
The InChIKey is MEEJSDSHMAEMIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3.ClH/c1-11-5-7(6(9)10)3-2-4-8-7;/h8H,2-5H2,1H3,(H,9,10);1H.
What are the key properties of 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride?
2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride has a molecular weight of 195.65 g/mol, XLogP of 0.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)pyrrolidine-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 119031719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).