6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one

C16H14ClNO2 — CID 47420565

IUPAC6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(OCc3cccc(Cl)c3)ccc2N1
InChIInChI=1S/C16H14ClNO2/c17-13-3-1-2-11(8-13)10-20-14-5-6-15-12(9-14)4-7-16(19)18-15/h1-3,5-6,8-9H,4,7,10H2,(H,18,19)
InChIKeyZOOFQUITRAUISA-UHFFFAOYSA-N
MW287.75 g/mol
LogP3.80
Rot. Bonds3

About 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one

6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 47420565) has the molecular formula C16H14ClNO2 and a molecular weight of 287.75 g/mol. Its IUPAC name is 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID47420565
Molecular FormulaC16H14ClNO2
Molecular Weight287.75 g/mol
Exact Mass287.07
IUPAC Name6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESO=C1CCc2cc(OCc3cccc(Cl)c3)ccc2N1
InChIInChI=1S/C16H14ClNO2/c17-13-3-1-2-11(8-13)10-20-14-5-6-15-12(9-14)4-7-16(19)18-15/h1-3,5-6,8-9H,4,7,10H2,(H,18,19)
InChIKeyZOOFQUITRAUISA-UHFFFAOYSA-N
XLogP3.80
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.75
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-[[4-(hydroxymethyl)phenyl]methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 115969585
6-[(3-amino-4-bromophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 115557423
6-[(2-hydrazinyl-4-pyridinyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 62466442
6-chloro-3,4-dihydro-1H-quinolin-2-one
CID 11240825
1,4-dichlorobenzene;6-(4-sulfanylbutoxy)-3,4-dihydro-1H-quinolin-2-one
CID 88753256
6-[(6-hydrazinyl-3-pyridinyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 62244306
N-[(3-chlorophenyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 86911732
6-pentoxy-3,4-dihydro-1H-quinolin-2-one
CID 42598028
7-[[3-(quinazolin-2-ylmethoxy)phenyl]methoxy]-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 19369492
(7R)-7-[4-[(3-chlorophenyl)methoxy]phenyl]-6,7-dihydro-4H-thieno[3,2-b]pyridin-5-one
CID 42590848
7-[4-[(3-chlorophenyl)methoxy]phenyl]-6,7-dihydro-4H-thieno[3,2-b]pyridin-5-one
CID 16764398
N-[2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]ethyl]-4-(phenoxymethyl)benzamide
CID 78891643

Frequently Asked Questions

What is the IUPAC name of 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one (CID 47420565) is 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one is O=C1CCc2cc(OCc3cccc(Cl)c3)ccc2N1.
What is the InChIKey of 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is ZOOFQUITRAUISA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNO2/c17-13-3-1-2-11(8-13)10-20-14-5-6-15-12(9-14)4-7-16(19)18-15/h1-3,5-6,8-9H,4,7,10H2,(H,18,19).
What are the key properties of 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one?
6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 287.75 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-chlorophenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 47420565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).