(3-bromofuran-2-yl)-quinolin-8-ylmethanone

C14H8BrNO2 — CID 105101694

IUPAC(3-bromofuran-2-yl)-quinolin-8-ylmethanone
SMILESO=C(c1occc1Br)c1cccc2cccnc12
InChIInChI=1S/C14H8BrNO2/c15-11-6-8-18-14(11)13(17)10-5-1-3-9-4-2-7-16-12(9)10/h1-8H
InChIKeyWQWUVCYHJYQAMV-UHFFFAOYSA-N
MW302.13 g/mol
LogP3.82
Rot. Bonds2

About (3-bromofuran-2-yl)-quinolin-8-ylmethanone

(3-bromofuran-2-yl)-quinolin-8-ylmethanone (PubChem CID 105101694) has the molecular formula C14H8BrNO2 and a molecular weight of 302.13 g/mol. Its IUPAC name is (3-bromofuran-2-yl)-quinolin-8-ylmethanone.

Molecular Properties

Compound Name(3-bromofuran-2-yl)-quinolin-8-ylmethanone
PubChem CID105101694
Molecular FormulaC14H8BrNO2
Molecular Weight302.13 g/mol
Exact Mass300.97
IUPAC Name(3-bromofuran-2-yl)-quinolin-8-ylmethanone
SMILESO=C(c1occc1Br)c1cccc2cccnc12
InChIInChI=1S/C14H8BrNO2/c15-11-6-8-18-14(11)13(17)10-5-1-3-9-4-2-7-16-12(9)10/h1-8H
InChIKeyWQWUVCYHJYQAMV-UHFFFAOYSA-N
XLogP3.82
TPSA43.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.13
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-bromofuran-2-yl)-quinolin-5-ylmethanone
CID 105101672
pyrimidin-2-yl(quinolin-8-yl)methanone
CID 81220703
(5-chlorofuran-2-yl)-quinolin-8-ylmethanone
CID 106691206
1-quinolin-8-ylprop-2-yn-1-one
CID 105108252
palladium;quinoline-8-carboxylic acid
CID 174945118
(2-ethylphenyl)-quinolin-8-ylmethanone
CID 115790630
1,3-dihydro-2-benzofuran-5-yl(quinolin-8-yl)methanone
CID 115608476
N-(2-bromophenyl)quinoline-8-carboxamide
CID 60651885
(2,5-dimethylfuran-3-yl)-quinolin-8-ylmethanone
CID 113230028
(4-tert-butylphenyl)-quinolin-8-ylmethanone
CID 102581511
(2-methoxyphenyl)-quinolin-8-ylmethanone
CID 81215631
tricopper;bis(2-oxidobenzoate);bis(quinolin-8-olate)
CID 69050117

Frequently Asked Questions

What is the IUPAC name of (3-bromofuran-2-yl)-quinolin-8-ylmethanone?
The IUPAC name of (3-bromofuran-2-yl)-quinolin-8-ylmethanone (CID 105101694) is (3-bromofuran-2-yl)-quinolin-8-ylmethanone.
What is the SMILES notation for (3-bromofuran-2-yl)-quinolin-8-ylmethanone?
The canonical SMILES for (3-bromofuran-2-yl)-quinolin-8-ylmethanone is O=C(c1occc1Br)c1cccc2cccnc12.
What is the InChIKey of (3-bromofuran-2-yl)-quinolin-8-ylmethanone?
The InChIKey is WQWUVCYHJYQAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8BrNO2/c15-11-6-8-18-14(11)13(17)10-5-1-3-9-4-2-7-16-12(9)10/h1-8H.
What are the key properties of (3-bromofuran-2-yl)-quinolin-8-ylmethanone?
(3-bromofuran-2-yl)-quinolin-8-ylmethanone has a molecular weight of 302.13 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromofuran-2-yl)-quinolin-8-ylmethanone is sourced from PubChem (CID 105101694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).