6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine

C23H23N3O — CID 23757991

IUPAC6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine
SMILES[H]/N=c1\ccc2c(-c3ccc(OC)cc3)c3ccc(N(C)C)cc3n(C)c-2c1
InChIInChI=1S/C23H23N3O/c1-25(2)17-8-12-20-22(14-17)26(3)21-13-16(24)7-11-19(21)23(20)15-5-9-18(27-4)10-6-15/h5-14,24H,1-4H3/b24-16+
InChIKeyYDVIABOCYNDGRX-LFVJCYFKSA-N
MW357.46 g/mol
LogP4.50
Rot. Bonds3

About 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine

6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine (PubChem CID 23757991) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine.

Molecular Properties

Compound Name6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine
PubChem CID23757991
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine
SMILES[H]/N=c1\ccc2c(-c3ccc(OC)cc3)c3ccc(N(C)C)cc3n(C)c-2c1
InChIInChI=1S/C23H23N3O/c1-25(2)17-8-12-20-22(14-17)26(3)21-13-16(24)7-11-19(21)23(20)15-5-9-18(27-4)10-6-15/h5-14,24H,1-4H3/b24-16+
InChIKeyYDVIABOCYNDGRX-LFVJCYFKSA-N
XLogP4.50
TPSA41.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4,4'-[(4-Methoxyphenyl)methylene]bis(N,N-dimethylaniline)
CID 348623
N'-[2-(4-methoxyphenyl)ethyl]-N,N-dimethyl-N'-(4-methylphenyl)ethane-1,2-diamine
CID 155531121
4-({[3-(4-Methoxyphenyl)-3-phenylpropyl]amino}methyl)-N,N-dimethylaniline
CID 22331912
4-(((3-(4-methoxyphenyl)-4-methylpentyl)amino)methyl)-N,N-dimethylaniline
CID 3352804
[6-(Dimethylamino)-9-(3-methoxyphenyl)selenoxanthen-3-ylidene]-dimethylazanium bromide
CID 44566029
[6-(Dimethylamino)-9-(3-methoxyphenyl)telluroxanthen-3-ylidene]-dimethylazanium bromide
CID 44566043
2-[(E)-2-(4-methoxyphenyl)ethenyl]-1,3,3-trimethylindol-1-ium iodide
CID 71463214
N'-(4-methoxybenzyl)-N,N-dimethylbenzene-1,3-diamine
CID 783792
(E)-4-(2-(4-Methoxyphenyl)ethenyl)benzenamine, N,N-dimethyl-
CID 5463087
4'-Methoxy-N,N-dimethyl[1,1'-biphenyl]-4-amine
CID 2758507
4-[(4-Methoxyphenyl)methyl]-N,N-dimethylaniline
CID 15419128
4-pi-Peridino-4'-methoxy-biphenyl
CID 54529993

Frequently Asked Questions

What is the IUPAC name of 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine?
The IUPAC name of 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine (CID 23757991) is 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine.
What is the SMILES notation for 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine?
The canonical SMILES for 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine is [H]/N=c1\ccc2c(-c3ccc(OC)cc3)c3ccc(N(C)C)cc3n(C)c-2c1.
What is the InChIKey of 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine?
The InChIKey is YDVIABOCYNDGRX-LFVJCYFKSA-N. The full InChI is InChI=1S/C23H23N3O/c1-25(2)17-8-12-20-22(14-17)26(3)21-13-16(24)7-11-19(21)23(20)15-5-9-18(27-4)10-6-15/h5-14,24H,1-4H3/b24-16+.
What are the key properties of 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine?
6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine has a molecular weight of 357.46 g/mol, XLogP of 4.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imino-9-(4-methoxyphenyl)-N,N,10-trimethylacridin-3-amine is sourced from PubChem (CID 23757991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).