(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone

C11H14BrNO2 — CID 130573801

IUPAC(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone
SMILESCNC1(C(=O)c2occc2Br)CCCC1
InChIInChI=1S/C11H14BrNO2/c1-13-11(5-2-3-6-11)10(14)9-8(12)4-7-15-9/h4,7,13H,2-3,5-6H2,1H3
InChIKeyAXVZJKMTSRLVMS-UHFFFAOYSA-N
MW272.14 g/mol
LogP2.76
Rot. Bonds3

About (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone

(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone (PubChem CID 130573801) has the molecular formula C11H14BrNO2 and a molecular weight of 272.14 g/mol. Its IUPAC name is (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone.

Molecular Properties

Compound Name(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone
PubChem CID130573801
Molecular FormulaC11H14BrNO2
Molecular Weight272.14 g/mol
Exact Mass271.02
IUPAC Name(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone
SMILESCNC1(C(=O)c2occc2Br)CCCC1
InChIInChI=1S/C11H14BrNO2/c1-13-11(5-2-3-6-11)10(14)9-8(12)4-7-15-9/h4,7,13H,2-3,5-6H2,1H3
InChIKeyAXVZJKMTSRLVMS-UHFFFAOYSA-N
XLogP2.76
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.14
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone?
The IUPAC name of (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone (CID 130573801) is (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone.
What is the SMILES notation for (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone?
The canonical SMILES for (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone is CNC1(C(=O)c2occc2Br)CCCC1.
What is the InChIKey of (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone?
The InChIKey is AXVZJKMTSRLVMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrNO2/c1-13-11(5-2-3-6-11)10(14)9-8(12)4-7-15-9/h4,7,13H,2-3,5-6H2,1H3.
What are the key properties of (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone?
(3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone has a molecular weight of 272.14 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromofuran-2-yl)-[1-(methylamino)cyclopentyl]methanone is sourced from PubChem (CID 130573801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).