1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one

C15H15ClN2O2 — CID 110672815

IUPAC1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one
SMILESCCC(=O)N1CCc2cc3cc(OC)c(Cl)cc3nc21
InChIInChI=1S/C15H15ClN2O2/c1-3-14(19)18-5-4-9-6-10-7-13(20-2)11(16)8-12(10)17-15(9)18/h6-8H,3-5H2,1-2H3
InChIKeyZTEPHHQVULWJCC-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.20
Rot. Bonds2

About 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one

1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one (PubChem CID 110672815) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one.

Molecular Properties

Compound Name1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one
PubChem CID110672815
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one
SMILESCCC(=O)N1CCc2cc3cc(OC)c(Cl)cc3nc21
InChIInChI=1S/C15H15ClN2O2/c1-3-14(19)18-5-4-9-6-10-7-13(20-2)11(16)8-12(10)17-15(9)18/h6-8H,3-5H2,1-2H3
InChIKeyZTEPHHQVULWJCC-UHFFFAOYSA-N
XLogP3.20
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one with MolForge

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Related Compounds

(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-(furan-2-yl)methanone
CID 110672820
methyl 4-(7-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-4-oxobutanoate
CID 110673152
1-(6,7-dimethoxy-1-methylidene-3,4-dihydroisoquinolin-2-yl)propan-1-one
CID 14845147
N-(3-chloro-4-methoxyphenyl)-1-propanoyl-2,3-dihydroindole-5-carboxamide
CID 53080866
1-(8-chloro-9-methoxy-5,6-dihydropyrrolo[2,1-a]isoquinolin-1-yl)propan-1-one
CID 11630667
ethane;methyl 2-methoxy-4-(1-propanoyl-2,3-dihydroindol-5-yl)benzoate
CID 153360813
1-[4-(2,5-dichloro-4-methoxybenzoyl)-1,4-diazepan-1-yl]propan-1-one
CID 110805791
(4-methoxyphenyl)-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)methanone
CID 20996288
9-chloro-8-methoxy-2,3,4,5-tetrahydro-1H-azepino[2,3-b]quinoline
CID 84638998
2,7-dichloro-6-methoxy-3-methylquinoline
CID 28809488
N-[2-(7-fluoro-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)-2-oxoethyl]benzamide
CID 110672755
2-methyl-1-(7-methyl-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one
CID 20996268

Frequently Asked Questions

What is the IUPAC name of 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one?
The IUPAC name of 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one (CID 110672815) is 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one.
What is the SMILES notation for 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one?
The canonical SMILES for 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one is CCC(=O)N1CCc2cc3cc(OC)c(Cl)cc3nc21.
What is the InChIKey of 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one?
The InChIKey is ZTEPHHQVULWJCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-3-14(19)18-5-4-9-6-10-7-13(20-2)11(16)8-12(10)17-15(9)18/h6-8H,3-5H2,1-2H3.
What are the key properties of 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one?
1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one has a molecular weight of 290.75 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-chloro-6-methoxy-2,3-dihydropyrrolo[2,3-b]quinolin-1-yl)propan-1-one is sourced from PubChem (CID 110672815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).