2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide

C24H17Cl2N3O — CID 146562170

IUPAC2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide
SMILESO=C(NC1CCc2ccccc21)c1ccc2nc(-c3cccc(Cl)c3Cl)cnc2c1
InChIInChI=1S/C24H17Cl2N3O/c25-18-7-3-6-17(23(18)26)22-13-27-21-12-15(9-11-20(21)28-22)24(30)29-19-10-8-14-4-1-2-5-16(14)19/h1-7,9,11-13,19H,8,10H2,(H,29,30)
InChIKeyXAPDNUUGVVZLQB-UHFFFAOYSA-N
MW434.33 g/mol
LogP6.02
Rot. Bonds3

About 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide

2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide (PubChem CID 146562170) has the molecular formula C24H17Cl2N3O and a molecular weight of 434.33 g/mol. Its IUPAC name is 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide.

Molecular Properties

Compound Name2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide
PubChem CID146562170
Molecular FormulaC24H17Cl2N3O
Molecular Weight434.33 g/mol
Exact Mass433.07
IUPAC Name2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide
SMILESO=C(NC1CCc2ccccc21)c1ccc2nc(-c3cccc(Cl)c3Cl)cnc2c1
InChIInChI=1S/C24H17Cl2N3O/c25-18-7-3-6-17(23(18)26)22-13-27-21-12-15(9-11-20(21)28-22)24(30)29-19-10-8-14-4-1-2-5-16(14)19/h1-7,9,11-13,19H,8,10H2,(H,29,30)
InChIKeyXAPDNUUGVVZLQB-UHFFFAOYSA-N
XLogP6.02
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.33
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[(1S)-2,3-dihydro-1H-inden-1-yl]benzamide
CID 26288569
2-chloro-N-[(1R)-2,3-dihydro-1H-inden-1-yl]benzamide
CID 26288568
3-[5-amino-6-[N'-(methylamino)carbamimidoyl]pyrazin-2-yl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]benzamide
CID 68651901
N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide
CID 51281191
4-amino-N-(2,3-dihydro-1H-inden-1-yl)-3-nitrobenzamide
CID 42925944
2-chloro-N-(2,3-dihydro-1H-inden-1-yl)-6-fluorobenzamide
CID 42889076
2-chloro-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-4-carboxamide
CID 32694198
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide
CID 7688440
4-cyano-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 47126975
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-2-(1-methylpiperidin-4-yl)-3H-benzimidazole-5-carboxamide
CID 170948220
5-chloro-N-(2,3-dihydro-1H-inden-1-yl)-2-methoxypyridine-3-carboxamide
CID 171547623
3-(4-bromopyrazol-1-yl)-N-[(1S)-2,3-dihydro-1H-inden-1-yl]benzamide
CID 52538046

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide?
The IUPAC name of 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide (CID 146562170) is 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide.
What is the SMILES notation for 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide?
The canonical SMILES for 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide is O=C(NC1CCc2ccccc21)c1ccc2nc(-c3cccc(Cl)c3Cl)cnc2c1.
What is the InChIKey of 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide?
The InChIKey is XAPDNUUGVVZLQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17Cl2N3O/c25-18-7-3-6-17(23(18)26)22-13-27-21-12-15(9-11-20(21)28-22)24(30)29-19-10-8-14-4-1-2-5-16(14)19/h1-7,9,11-13,19H,8,10H2,(H,29,30).
What are the key properties of 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide?
2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide has a molecular weight of 434.33 g/mol, XLogP of 6.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorophenyl)-N-(2,3-dihydro-1H-inden-1-yl)quinoxaline-6-carboxamide is sourced from PubChem (CID 146562170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).