6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine

C24H21FN4O3S — CID 42643596

IUPAC6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine
SMILESCOc1ccc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)cc1F
InChIInChI=1S/C24H21FN4O3S/c1-32-23-7-6-19(13-21(23)25)33(30,31)29-11-9-20-17(15-29)8-10-26-24(20)28-18-12-16-4-2-3-5-22(16)27-14-18/h2-8,10,12-14H,9,11,15H2,1H3,(H,26,28)
InChIKeyAKDQHVCOBJEQLR-UHFFFAOYSA-N
MW464.52 g/mol
LogP4.27
Rot. Bonds5

About 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine

6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine (PubChem CID 42643596) has the molecular formula C24H21FN4O3S and a molecular weight of 464.52 g/mol. Its IUPAC name is 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine.

Molecular Properties

Compound Name6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine
PubChem CID42643596
Molecular FormulaC24H21FN4O3S
Molecular Weight464.52 g/mol
Exact Mass464.13
IUPAC Name6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine
SMILESCOc1ccc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)cc1F
InChIInChI=1S/C24H21FN4O3S/c1-32-23-7-6-19(13-21(23)25)33(30,31)29-11-9-20-17(15-29)8-10-26-24(20)28-18-12-16-4-2-3-5-22(16)27-14-18/h2-8,10,12-14H,9,11,15H2,1H3,(H,26,28)
InChIKeyAKDQHVCOBJEQLR-UHFFFAOYSA-N
XLogP4.27
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.52
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine with MolForge

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Related Compounds

2,4-difluoro-N-[2-methoxy-5-(4-pyridin-4-ylquinolin-6-yl)-3-pyridinyl]benzenesulfonamide
CID 58441681
2,4-difluoro-N-[2-methoxy-5-(4-pyridin-4-ylquinazolin-6-yl)-3-pyridinyl]benzenesulfonamide
CID 122178110
N-[5-(2-amino-4-pyridin-4-ylquinazolin-6-yl)-2-methoxy-3-pyridinyl]-2,4-difluorobenzenesulfonamide
CID 122178113
N2-(4-methoxyphenyl)-N4-(quinolin-3-yl)pyrimidine-2,4-diamine
CID 9967928
N-[[1-(benzenesulfonyl)indol-3-yl]methyl]-N'-(4-methoxyquinolin-2-yl)propane-1,3-diamine
CID 10185400
6-(2-fluoro-6-(methylsulfonyl)phenoxy)-N-(5-methylpyrazin-2-yl)quinazolin-4-amine
CID 23160316
N-(4-methoxyphenyl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridin-7-amine
CID 50940068
N-(4-fluorophenyl)-1-(4-methoxyphenyl)sulfonylpyrrolo[2,3-c]pyridin-7-amine
CID 50940069
2,4-difluoro-N-[2-methoxy-5-[4-(4-morpholinyl)-6-quinazolinyl]-3-pyridinyl]Benzenesulfonamide
CID 57545876
1-(4-methoxyphenyl)sulfonyl-N-phenylpyrrolo[2,3-c]pyridin-7-amine
CID 58149816
N-[5-(2-amino-3-phenyl-6-quinolyl)-2-methoxy-3-pyridyl]-2,4-difluoro-benzenesulfonamide
CID 66800530
N-[5-[2-amino-3-(4-morpholinophenyl)-6-quinolyl]-2-methoxy-3-pyridyl]-2,4-difluoro-benzenesulfonamide
CID 66806967

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine?
The IUPAC name of 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine (CID 42643596) is 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine.
What is the SMILES notation for 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine?
The canonical SMILES for 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine is COc1ccc(S(=O)(=O)N2CCc3c(ccnc3Nc3cnc4ccccc4c3)C2)cc1F.
What is the InChIKey of 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine?
The InChIKey is AKDQHVCOBJEQLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN4O3S/c1-32-23-7-6-19(13-21(23)25)33(30,31)29-11-9-20-17(15-29)8-10-26-24(20)28-18-12-16-4-2-3-5-22(16)27-14-18/h2-8,10,12-14H,9,11,15H2,1H3,(H,26,28).
What are the key properties of 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine?
6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine has a molecular weight of 464.52 g/mol, XLogP of 4.27, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoro-4-methoxyphenyl)sulfonyl-N-quinolin-3-yl-7,8-dihydro-5H-2,6-naphthyridin-1-amine is sourced from PubChem (CID 42643596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).