OQBUECMAMCREOE-ZETCQYMHSA-N

Name: OQBUECMAMCREOE-ZETCQYMHSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₈H₁₅F₂NO — CID 148811915

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

IUPAC(2S)-1-(2,2-difluoroethyl)-2-(methoxymethyl)pyrrolidine

SMILESCOC[C@@H]1CCCN1CC(F)F

InChIInChI=1S/C8H15F2NO/c1-12-6-7-3-2-4-11(7)5-8(9)10/h7-8H,2-6H2,1H3/t7-/m0/s1

InChIKeyOQBUECMAMCREOE-ZETCQYMHSA-N

MW179.21 g/mol

LogP1.36

Rot. Bonds4

About OQBUECMAMCREOE-ZETCQYMHSA-N

OQBUECMAMCREOE-ZETCQYMHSA-N (PubChem CID 148811915) has the molecular formula C₈H₁₅F₂NO and a molecular weight of 179.21 g/mol. Its IUPAC name is (2S)-1-(2,2-difluoroethyl)-2-(methoxymethyl)pyrrolidine.

Molecular Properties

Compound Name	OQBUECMAMCREOE-ZETCQYMHSA-N
PubChem CID	148811915
Molecular Formula	C₈H₁₅F₂NO
Molecular Weight	179.21 g/mol
Exact Mass	179.11
IUPAC Name	(2S)-1-(2,2-difluoroethyl)-2-(methoxymethyl)pyrrolidine
SMILES	COC[C@@H]1CCCN1CC(F)F
InChI	InChI=1S/C8H15F2NO/c1-12-6-7-3-2-4-11(7)5-8(9)10/h7-8H,2-6H2,1H3/t7-/m0/s1
InChIKey	OQBUECMAMCREOE-ZETCQYMHSA-N
XLogP	1.36
TPSA	12.47 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds	4
Heavy Atoms	12
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	179.21
LogP ≤ 5	1.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of OQBUECMAMCREOE-ZETCQYMHSA-N?

The IUPAC name of OQBUECMAMCREOE-ZETCQYMHSA-N (CID 148811915) is (2S)-1-(2,2-difluoroethyl)-2-(methoxymethyl)pyrrolidine.

What is the SMILES notation for OQBUECMAMCREOE-ZETCQYMHSA-N?

The canonical SMILES for OQBUECMAMCREOE-ZETCQYMHSA-N is COC[C@@H]1CCCN1CC(F)F.

What is the InChIKey of OQBUECMAMCREOE-ZETCQYMHSA-N?

The InChIKey is OQBUECMAMCREOE-ZETCQYMHSA-N. The full InChI is InChI=1S/C8H15F2NO/c1-12-6-7-3-2-4-11(7)5-8(9)10/h7-8H,2-6H2,1H3/t7-/m0/s1.

What are the key properties of OQBUECMAMCREOE-ZETCQYMHSA-N?

OQBUECMAMCREOE-ZETCQYMHSA-N has a molecular weight of 179.21 g/mol, XLogP of 1.36, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for OQBUECMAMCREOE-ZETCQYMHSA-N is sourced from PubChem (CID 148811915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 148811915 — identifiers, structure, computed properties (public domain)

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