6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol

C18H11Cl2FN2O — CID 156882056

IUPAC6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol
SMILESCn1cc(O)c2cnc3c(-c4cccc(Cl)c4Cl)c(F)ccc3c21
InChIInChI=1S/C18H11Cl2FN2O/c1-23-8-14(24)11-7-22-17-10(18(11)23)5-6-13(21)15(17)9-3-2-4-12(19)16(9)20/h2-8,24H,1H3
InChIKeyZJRRSDZKYQYWKW-UHFFFAOYSA-N
MW361.20 g/mol
LogP5.55
Rot. Bonds1

About 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol

6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol (PubChem CID 156882056) has the molecular formula C18H11Cl2FN2O and a molecular weight of 361.20 g/mol. Its IUPAC name is 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol.

Molecular Properties

Compound Name6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol
PubChem CID156882056
Molecular FormulaC18H11Cl2FN2O
Molecular Weight361.20 g/mol
Exact Mass360.02
IUPAC Name6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol
SMILESCn1cc(O)c2cnc3c(-c4cccc(Cl)c4Cl)c(F)ccc3c21
InChIInChI=1S/C18H11Cl2FN2O/c1-23-8-14(24)11-7-22-17-10(18(11)23)5-6-13(21)15(17)9-3-2-4-12(19)16(9)20/h2-8,24H,1H3
InChIKeyZJRRSDZKYQYWKW-UHFFFAOYSA-N
XLogP5.55
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.20
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-6-(2,3,5-trifluorophenyl)pyrrolo[3,2-c]quinolin-3-ol
CID 156882057
8-(2,3-dichlorophenyl)-4-(dimethylamino)-7-fluoroquinoline-3-carboxylic acid
CID 156882069
ethyl 8-(2,3-dichlorophenyl)-4-(dimethylamino)-7-fluoroquinoline-3-carboxylate
CID 156882033
2-(2,3-dichlorophenyl)-1-methylimidazole
CID 110540593
4-amino-8-(3-chloro-2-fluorophenyl)quinazolin-7-ol
CID 178009457
3,5-bis(2,3-dichlorophenyl)-4-methyl-1,2,4-triazole
CID 11617680
3-(2,3-dichlorophenyl)-1,2,4,5-tetrafluorobenzene
CID 118803913
5-(2,3-dichlorophenyl)-2-methylpyridine
CID 173126972
2,3,5,6-tetrachloro-4-(2,3-dichlorophenyl)phenol;hydrate
CID 138395099
1,2-dichloro-3-(2-chloro-6-methylphenyl)benzene
CID 66251613
5-(2,3-dichlorophenyl)-3-fluoro-2-methoxypyridine
CID 133091081
3,5-bis(2,3-dichlorophenyl)-4-fluoropyridine
CID 133090739

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol?
The IUPAC name of 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol (CID 156882056) is 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol.
What is the SMILES notation for 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol?
The canonical SMILES for 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol is Cn1cc(O)c2cnc3c(-c4cccc(Cl)c4Cl)c(F)ccc3c21.
What is the InChIKey of 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol?
The InChIKey is ZJRRSDZKYQYWKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11Cl2FN2O/c1-23-8-14(24)11-7-22-17-10(18(11)23)5-6-13(21)15(17)9-3-2-4-12(19)16(9)20/h2-8,24H,1H3.
What are the key properties of 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol?
6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol has a molecular weight of 361.20 g/mol, XLogP of 5.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dichlorophenyl)-7-fluoro-1-methylpyrrolo[3,2-c]quinolin-3-ol is sourced from PubChem (CID 156882056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).