(3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid

Name: (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₀H₁₀BrNO₅ — CID 125118869

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

IUPAC(3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid

SMILESO=C(O)[C@H]1COCCN1C(=O)c1coc(Br)c1

InChIInChI=1S/C10H10BrNO5/c11-8-3-6(4-17-8)9(13)12-1-2-16-5-7(12)10(14)15/h3-4,7H,1-2,5H2,(H,14,15)/t7-/m1/s1

InChIKeyZGHRKJDSFDBXDB-SSDOTTSWSA-N

MW304.10 g/mol

LogP0.97

Rot. Bonds2

About (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid

(3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid (PubChem CID 125118869) has the molecular formula C₁₀H₁₀BrNO₅ and a molecular weight of 304.10 g/mol. Its IUPAC name is (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid.

Molecular Properties

Compound Name	(3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid
PubChem CID	125118869
Molecular Formula	C₁₀H₁₀BrNO₅
Molecular Weight	304.10 g/mol
Exact Mass	302.97
IUPAC Name	(3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid
SMILES	O=C(O)[C@H]1COCCN1C(=O)c1coc(Br)c1
InChI	InChI=1S/C10H10BrNO5/c11-8-3-6(4-17-8)9(13)12-1-2-16-5-7(12)10(14)15/h3-4,7H,1-2,5H2,(H,14,15)/t7-/m1/s1
InChIKey	ZGHRKJDSFDBXDB-SSDOTTSWSA-N
XLogP	0.97
TPSA	79.98 Å²
H-Bond Donors	1
H-Bond Acceptors	4
Rotatable Bonds	2
Heavy Atoms	17
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	304.10
LogP ≤ 5	0.97
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid?

The IUPAC name of (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid (CID 125118869) is (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid.

What is the SMILES notation for (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid?

The canonical SMILES for (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid is O=C(O)[C@H]1COCCN1C(=O)c1coc(Br)c1.

What is the InChIKey of (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid?

The InChIKey is ZGHRKJDSFDBXDB-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H10BrNO5/c11-8-3-6(4-17-8)9(13)12-1-2-16-5-7(12)10(14)15/h3-4,7H,1-2,5H2,(H,14,15)/t7-/m1/s1.

What are the key properties of (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid?

(3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid has a molecular weight of 304.10 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (3R)-4-(5-bromofuran-3-carbonyl)morpholine-3-carboxylic acid is sourced from PubChem (CID 125118869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 125118869 — identifiers, structure, computed properties (public domain)

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