5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide

C11H15BrN2O2 — CID 104972060

IUPAC5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
SMILESO=C(NCC[C@H]1CCCN1)c1ccc(Br)o1
InChIInChI=1S/C11H15BrN2O2/c12-10-4-3-9(16-10)11(15)14-7-5-8-2-1-6-13-8/h3-4,8,13H,1-2,5-7H2,(H,14,15)/t8-/m1/s1
InChIKeyRLUUORXKCQUVQN-MRVPVSSYSA-N
MW287.16 g/mol
LogP1.91
Rot. Bonds4

About 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide

5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide (PubChem CID 104972060) has the molecular formula C11H15BrN2O2 and a molecular weight of 287.16 g/mol. Its IUPAC name is 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
PubChem CID104972060
Molecular FormulaC11H15BrN2O2
Molecular Weight287.16 g/mol
Exact Mass286.03
IUPAC Name5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
SMILESO=C(NCC[C@H]1CCCN1)c1ccc(Br)o1
InChIInChI=1S/C11H15BrN2O2/c12-10-4-3-9(16-10)11(15)14-7-5-8-2-1-6-13-8/h3-4,8,13H,1-2,5-7H2,(H,14,15)/t8-/m1/s1
InChIKeyRLUUORXKCQUVQN-MRVPVSSYSA-N
XLogP1.91
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.16
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide
CID 104972070
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-1-benzofuran-2-carboxamide
CID 104972010
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-1-benzofuran-2-carboxamide
CID 104955292
2-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]benzamide
CID 104972061
5-bromo-N-(3-cyclopropylpropyl)furan-2-carboxamide
CID 115635897
4-oxo-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]chromene-2-carboxamide
CID 104955209
5-bromo-N-(morpholin-3-ylmethyl)furan-2-carboxamide
CID 103548570
3-bromo-4-methyl-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793684
2,6-difluoro-N-(2-pyrrolidin-2-ylethyl)benzamide
CID 114793746
2-(azepan-2-yl)-1-(5-bromofuran-2-yl)ethanone
CID 104653573
2-(4-fluorophenyl)-N-(2-piperidin-2-ylethyl)acetamide
CID 24704522
4-bromo-3-fluoro-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]benzamide
CID 104955112

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
The IUPAC name of 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide (CID 104972060) is 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
The canonical SMILES for 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide is O=C(NCC[C@H]1CCCN1)c1ccc(Br)o1.
What is the InChIKey of 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
The InChIKey is RLUUORXKCQUVQN-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15BrN2O2/c12-10-4-3-9(16-10)11(15)14-7-5-8-2-1-6-13-8/h3-4,8,13H,1-2,5-7H2,(H,14,15)/t8-/m1/s1.
What are the key properties of 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide?
5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide has a molecular weight of 287.16 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]furan-2-carboxamide is sourced from PubChem (CID 104972060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).