5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine

C24H16ClN3 — CID 145195439

IUPAC5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine
SMILESClc1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2nccnc12
InChIInChI=1S/C24H16ClN3/c25-21-19-13-7-8-14-20(19)24(23-22(21)26-15-16-27-23)28(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-16H
InChIKeyOQRLVHDSCQNYLJ-UHFFFAOYSA-N
MW381.87 g/mol
LogP6.91
Rot. Bonds3

About 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine

5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine (PubChem CID 145195439) has the molecular formula C24H16ClN3 and a molecular weight of 381.87 g/mol. Its IUPAC name is 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine.

Molecular Properties

Compound Name5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine
PubChem CID145195439
Molecular FormulaC24H16ClN3
Molecular Weight381.87 g/mol
Exact Mass381.10
IUPAC Name5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine
SMILESClc1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2nccnc12
InChIInChI=1S/C24H16ClN3/c25-21-19-13-7-8-14-20(19)24(23-22(21)26-15-16-27-23)28(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-16H
InChIKeyOQRLVHDSCQNYLJ-UHFFFAOYSA-N
XLogP6.91
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.87
LogP ≤ 56.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

6,7-dimethyl-5-N,8-N-diphenyl-5-N,8-N-bis[4-(N-phenylanilino)phenyl]quinoxaline-5,8-diamine
CID 58988982
5-N,8-N-diphenyl-5-N,8-N-bis[4-(N-phenylanilino)phenyl]quinoxaline-5,8-diamine
CID 58988979
9-N,9-N,10-N,10-N-tetrakis(4-chlorophenyl)anthracene-9,10-diamine
CID 20665542
9-N,10-N-diphenyl-9-N,10-N-bis(4-phenylphenyl)anthracene-9,10-diamine
CID 59133440
9-N,10-N-diphenyl-9-N,10-N-bis(4-phenylphenyl)phenanthrene-9,10-diamine
CID 22105096
N,N-diphenyl-4-[8-[4-(N-phenylanilino)phenyl]quinoxalin-5-yl]aniline
CID 102293177
9-N,10-N-bis(4-phenylphenyl)-9-N,10-N-dipyridin-3-ylanthracene-9,10-diamine
CID 123403469
ethane;10-ethynyl-N,N-diphenylanthracen-9-amine
CID 145120121
7-N,7-N,12-N,12-N-tetraphenylbenzo[a]anthracene-7,12-diamine
CID 59133281
10-N-naphthalen-2-yl-10-N-phenylanthracene-9,10-diamine
CID 91020941
acetylene;N,N-diphenylaniline
CID 162160270
9-N,9-N,10-N-triphenyl-10-N-[4-[(Z)-2-phenylethenyl]phenyl]anthracene-9,10-diamine
CID 145488159

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine?
The IUPAC name of 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine (CID 145195439) is 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine.
What is the SMILES notation for 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine?
The canonical SMILES for 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine is Clc1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2nccnc12.
What is the InChIKey of 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine?
The InChIKey is OQRLVHDSCQNYLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16ClN3/c25-21-19-13-7-8-14-20(19)24(23-22(21)26-15-16-27-23)28(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-16H.
What are the key properties of 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine?
5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine has a molecular weight of 381.87 g/mol, XLogP of 6.91, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N,N-diphenylbenzo[g]quinoxalin-10-amine is sourced from PubChem (CID 145195439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).