(5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone

C10H5BrFNO2 — CID 130643801

IUPAC(5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone
SMILESO=C(c1coc(Br)c1)c1ccncc1F
InChIInChI=1S/C10H5BrFNO2/c11-9-3-6(5-15-9)10(14)7-1-2-13-4-8(7)12/h1-5H
InChIKeyGBTPYLVFWDSUQB-UHFFFAOYSA-N
MW270.06 g/mol
LogP2.81
Rot. Bonds2

About (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone

(5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone (PubChem CID 130643801) has the molecular formula C10H5BrFNO2 and a molecular weight of 270.06 g/mol. Its IUPAC name is (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone.

Molecular Properties

Compound Name(5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone
PubChem CID130643801
Molecular FormulaC10H5BrFNO2
Molecular Weight270.06 g/mol
Exact Mass268.95
IUPAC Name(5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone
SMILESO=C(c1coc(Br)c1)c1ccncc1F
InChIInChI=1S/C10H5BrFNO2/c11-9-3-6(5-15-9)10(14)7-1-2-13-4-8(7)12/h1-5H
InChIKeyGBTPYLVFWDSUQB-UHFFFAOYSA-N
XLogP2.81
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.06
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-fluoro-4-pyridinyl)-(2-methyl-4-pyridinyl)methanone
CID 106754774
(5-bromothiophen-2-yl)-(3-fluoro-4-pyridinyl)methanone
CID 104737850
(2,5-dimethylpyrazol-3-yl)-(3-fluoro-4-pyridinyl)methanone
CID 105129319
(3-bromoquinolin-2-yl)-(3-fluoro-4-pyridinyl)methanone
CID 104737946
(3-bromo-4-pyridinyl)-phenylmethanone
CID 102419732
(3-fluoro-4-pyridinyl)-(2-methyl-1,2,4-triazol-3-yl)methanone
CID 130529576
(3-chlorothiophen-2-yl)-(3-fluoro-4-pyridinyl)methanone
CID 115802142
N-[(4-bromothiophen-2-yl)methyl]-3-fluoro-N-methylpyridine-4-carboxamide
CID 64950094
(4-amino-3-pyridinyl)-(3-bromo-4-fluorophenyl)methanone
CID 82809025
(4-bromo-1-ethylpyrazol-5-yl)-(3-fluoro-4-pyridinyl)methanone
CID 114641961
3-fluoro-N,N-dimethylpyridine-4-carboxamide
CID 64950687
4-(4-fluorobenzoyl)pyridine-3-carboxylic acid
CID 10752867

Frequently Asked Questions

What is the IUPAC name of (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone?
The IUPAC name of (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone (CID 130643801) is (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone.
What is the SMILES notation for (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone?
The canonical SMILES for (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone is O=C(c1coc(Br)c1)c1ccncc1F.
What is the InChIKey of (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone?
The InChIKey is GBTPYLVFWDSUQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5BrFNO2/c11-9-3-6(5-15-9)10(14)7-1-2-13-4-8(7)12/h1-5H.
What are the key properties of (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone?
(5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone has a molecular weight of 270.06 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-bromofuran-3-yl)-(3-fluoro-4-pyridinyl)methanone is sourced from PubChem (CID 130643801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).