2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone

C20H17ClN2O2 — CID 20996239

IUPAC2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone
SMILESCc1ccc2nc3c(cc2c1)CCN3C(=O)COc1ccc(Cl)cc1
InChIInChI=1S/C20H17ClN2O2/c1-13-2-7-18-15(10-13)11-14-8-9-23(20(14)22-18)19(24)12-25-17-5-3-16(21)4-6-17/h2-7,10-11H,8-9,12H2,1H3
InChIKeyCOEYJCPEIDHVAP-UHFFFAOYSA-N
MW352.82 g/mol
LogP4.16
Rot. Bonds3

About 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone

2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone (PubChem CID 20996239) has the molecular formula C20H17ClN2O2 and a molecular weight of 352.82 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone
PubChem CID20996239
Molecular FormulaC20H17ClN2O2
Molecular Weight352.82 g/mol
Exact Mass352.10
IUPAC Name2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone
SMILESCc1ccc2nc3c(cc2c1)CCN3C(=O)COc1ccc(Cl)cc1
InChIInChI=1S/C20H17ClN2O2/c1-13-2-7-18-15(10-13)11-14-8-9-23(20(14)22-18)19(24)12-25-17-5-3-16(21)4-6-17/h2-7,10-11H,8-9,12H2,1H3
InChIKeyCOEYJCPEIDHVAP-UHFFFAOYSA-N
XLogP4.16
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.82
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone with MolForge

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Related Compounds

(4-methoxyphenyl)-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)methanone
CID 20996236
2-[4-(4-chlorobenzoyl)phenoxy]-1-(2,3-dihydroindol-1-yl)ethanone
CID 7919205
(4-methoxyphenyl)-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)methanone
CID 20996288
1-(5-methyl-2,3-dihydroindol-1-yl)-2-(3-methyl-4-propan-2-ylphenoxy)ethanone
CID 155953056
2-(4-chlorophenoxy)-1-(4-hydroxy-4-methylpiperidin-1-yl)ethanone
CID 80706729
2-methyl-1-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one
CID 20996268
2-(4-chlorophenoxy)-1-[4-[2-(3,4-dimethylphenoxy)acetyl]-1,4-diazepan-1-yl]ethanone
CID 108546619
methyl 4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-4-oxobutanoate
CID 110673152
1-(4-chlorophenyl)-2-(4-methylphenoxy)ethanone
CID 43413080
2-(4-chlorophenoxy)-1-(3-hydroxy-3-methylpyrrolidin-1-yl)ethanone
CID 103726935
8-[2-(3,5-dimethylphenoxy)acetyl]-6,7-dihydro-5H-1,8-naphthyridine-2-carboxamide
CID 126824866
1-[4-[2-(2,4-dichlorophenoxy)acetyl]piperazin-1-yl]-2-(4-methylphenoxy)ethanone
CID 108536086

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone?
The IUPAC name of 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone (CID 20996239) is 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone.
What is the SMILES notation for 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone?
The canonical SMILES for 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone is Cc1ccc2nc3c(cc2c1)CCN3C(=O)COc1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone?
The InChIKey is COEYJCPEIDHVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O2/c1-13-2-7-18-15(10-13)11-14-8-9-23(20(14)22-18)19(24)12-25-17-5-3-16(21)4-6-17/h2-7,10-11H,8-9,12H2,1H3.
What are the key properties of 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone?
2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone has a molecular weight of 352.82 g/mol, XLogP of 4.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-1-(6-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)ethanone is sourced from PubChem (CID 20996239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).