Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride

Name: Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₈H₁₅ClFNO₂ — CID 155821412

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACmethyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride

SMILESCOC(=O)C1(CCF)CCCN1.Cl

InChIInChI=1S/C8H14FNO2.ClH/c1-12-7(11)8(4-5-9)3-2-6-10-8;/h10H,2-6H2,1H3;1H

InChIKeyUNMRSXZJHGYJMF-UHFFFAOYSA-N

MW211.66 g/mol

LogP1.06

Rot. Bonds3

About Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride

Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride (PubChem CID 155821412) has the molecular formula C₈H₁₅ClFNO₂ and a molecular weight of 211.66 g/mol. Its IUPAC name is methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride.

Molecular Properties

Compound Name	Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride
PubChem CID	155821412
Molecular Formula	C₈H₁₅ClFNO₂
Molecular Weight	211.66 g/mol
Exact Mass	211.08
IUPAC Name	methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride
SMILES	COC(=O)C1(CCF)CCCN1.Cl
InChI	InChI=1S/C8H14FNO2.ClH/c1-12-7(11)8(4-5-9)3-2-6-10-8;/h10H,2-6H2,1H3;1H
InChIKey	UNMRSXZJHGYJMF-UHFFFAOYSA-N
XLogP	1.06
TPSA	38.33 Å²
H-Bond Donors	1
H-Bond Acceptors	3
Rotatable Bonds	3
Heavy Atoms	13
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	211.66
LogP ≤ 5	1.06
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride?

The IUPAC name of Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride (CID 155821412) is methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride.

What is the SMILES notation for Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride?

The canonical SMILES for Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride is COC(=O)C1(CCF)CCCN1.Cl.

What is the InChIKey of Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride?

The InChIKey is UNMRSXZJHGYJMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14FNO2.ClH/c1-12-7(11)8(4-5-9)3-2-6-10-8;/h10H,2-6H2,1H3;1H.

What are the key properties of Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride?

Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride has a molecular weight of 211.66 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for Methyl 2-(2-fluoroethyl)pyrrolidine-2-carboxylate;hydrochloride is sourced from PubChem (CID 155821412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 155821412 — identifiers, structure, computed properties (public domain)

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