7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one

C13H8ClNO3 — CID 54717240

IUPAC7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccco1
InChIInChI=1S/C13H8ClNO3/c14-7-3-4-8-9(6-7)15-13(17)11(12(8)16)10-2-1-5-18-10/h1-6H,(H2,15,16,17)
InChIKeyUFBBTIXVJYGCOQ-UHFFFAOYSA-N
MW261.66 g/mol
LogP3.15
Rot. Bonds1

About 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one

7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one (PubChem CID 54717240) has the molecular formula C13H8ClNO3 and a molecular weight of 261.66 g/mol. Its IUPAC name is 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one.

Molecular Properties

Compound Name7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one
PubChem CID54717240
Molecular FormulaC13H8ClNO3
Molecular Weight261.66 g/mol
Exact Mass261.02
IUPAC Name7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one
SMILESO=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccco1
InChIInChI=1S/C13H8ClNO3/c14-7-3-4-8-9(6-7)15-13(17)11(12(8)16)10-2-1-5-18-10/h1-6H,(H2,15,16,17)
InChIKeyUFBBTIXVJYGCOQ-UHFFFAOYSA-N
XLogP3.15
TPSA66.23 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.66
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-{[3-(2-Furyl)acryloyl]amino}benzoic acid
CID 879444
4-Hydroxy-7-chloroquinolone,3-(2-methylfuran-5YL
CID 54719379
methyl 4-chloro-2-[[(E)-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]benzoate
CID 2146469
7-chloro-3-[3-(furan-3-ylmethyl)phenyl]-4-hydroxy-1H-quinolin-2-one
CID 54698882
4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid
CID 763463
(7-Chloro-2,4-dihydroxyquinolin-3-yl)(furan-2-yl)methanone
CID 54735344
4-Chloro-2-(furan-2-ylmethylamino)benzoic acid
CID 556937
N-(3-chloro-4-fluorophenyl)-2-methylfuran-3-carboxamide
CID 705602
4-Chloro-2-(2-methylfuran-3-amido)benzoic acid
CID 16771823
(3E)-6-chloro-3-(furan-2-ylmethylidene)-1H-indol-2-one
CID 963020
(E)-6-chloro-3-(3-(furan-2-yl)acryloyl)-4-phenylquinolin-2(1H)-one
CID 5343342
N-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 896199

Frequently Asked Questions

What is the IUPAC name of 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one?
The IUPAC name of 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one (CID 54717240) is 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one.
What is the SMILES notation for 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one?
The canonical SMILES for 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one is O=c1[nH]c2cc(Cl)ccc2c(O)c1-c1ccco1.
What is the InChIKey of 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one?
The InChIKey is UFBBTIXVJYGCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8ClNO3/c14-7-3-4-8-9(6-7)15-13(17)11(12(8)16)10-2-1-5-18-10/h1-6H,(H2,15,16,17).
What are the key properties of 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one?
7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one has a molecular weight of 261.66 g/mol, XLogP of 3.15, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-3-(furan-2-yl)-4-hydroxy-1H-quinolin-2-one is sourced from PubChem (CID 54717240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).