3-carbazol-9-yl-N-methyl-N-phenylaniline

C25H20N2 — CID 59211086

IUPAC3-carbazol-9-yl-N-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1cccc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C25H20N2/c1-26(19-10-3-2-4-11-19)20-12-9-13-21(18-20)27-24-16-7-5-14-22(24)23-15-6-8-17-25(23)27/h2-18H,1H3
InChIKeyJNEVDSTWXTVKOE-UHFFFAOYSA-N
MW348.45 g/mol
LogP6.55
Rot. Bonds3

About 3-carbazol-9-yl-N-methyl-N-phenylaniline

3-carbazol-9-yl-N-methyl-N-phenylaniline (PubChem CID 59211086) has the molecular formula C25H20N2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 3-carbazol-9-yl-N-methyl-N-phenylaniline.

Molecular Properties

Compound Name3-carbazol-9-yl-N-methyl-N-phenylaniline
PubChem CID59211086
Molecular FormulaC25H20N2
Molecular Weight348.45 g/mol
Exact Mass348.16
IUPAC Name3-carbazol-9-yl-N-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1cccc(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C25H20N2/c1-26(19-10-3-2-4-11-19)20-12-9-13-21(18-20)27-24-16-7-5-14-22(24)23-15-6-8-17-25(23)27/h2-18H,1H3
InChIKeyJNEVDSTWXTVKOE-UHFFFAOYSA-N
XLogP6.55
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-carbazol-9-ylphenyl)-N-methylnaphthalen-2-amine
CID 58903517
N-methyl-N-(4-methylphenyl)-9-phenylcarbazol-3-amine
CID 58903567
3-carbazol-9-yl-N-(3-carbazol-9-ylphenyl)-N-methylaniline;7-carbazol-9-yl-9-methyl-N,N-diphenylcarbazol-2-amine;1-N-(3-carbazol-9-ylphenyl)-1-N-methyl-3-N,3-N-diphenylbenzene-1,3-diamine;2,7-di(carbazol-9-yl)-9-methylcarbazole;9-methyl-2-N,2-N,7-N,7-N-tetraphenylcarbazole-2,7-diamine
CID 159147766
3-N-(3-carbazol-9-ylphenyl)-1-N,1-N,3-N,5-N,5-N-pentakis-phenylbenzene-1,3,5-triamine
CID 90061335
3-[2-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-N,N-diphenylaniline
CID 170132805
N-(4-tert-butylphenyl)-3-carbazol-9-yl-N-methylaniline;3-carbazol-9-yl-N-methyl-N-(4-phenylphenyl)aniline;N-(3-carbazol-9-ylphenyl)-N-methyl-2-phenylaniline;N-(3-carbazol-9-ylphenyl)-N-methyl-3-phenylaniline
CID 158008301
9-(3-carbazol-9-ylphenyl)carbazole;methane
CID 157215827
N-(3-carbazol-9-ylphenyl)-N-phenyl-3-tritioaniline
CID 59196853
3-carbazol-9-yl-9-methylcarbazole;4-carbazol-9-yl-N-methyl-N-phenylaniline;9-methyl-N,N-diphenylcarbazol-3-amine
CID 160890732
3-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-9-phenylcarbazole
CID 146337769
N-(4-isocyanophenyl)-N-methyl-9-phenylcarbazol-3-amine;N-methyl-N,9-diphenylcarbazol-3-amine;N-methyl-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 165110598
9-[3-carbazol-9-yl-5-[[3,5-di(carbazol-9-yl)phenyl]methyl]phenyl]carbazole;3,5-di(carbazol-9-yl)-N-[3,5-di(carbazol-9-yl)phenyl]-N-methylaniline
CID 158699087

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-N-methyl-N-phenylaniline?
The IUPAC name of 3-carbazol-9-yl-N-methyl-N-phenylaniline (CID 59211086) is 3-carbazol-9-yl-N-methyl-N-phenylaniline.
What is the SMILES notation for 3-carbazol-9-yl-N-methyl-N-phenylaniline?
The canonical SMILES for 3-carbazol-9-yl-N-methyl-N-phenylaniline is CN(c1ccccc1)c1cccc(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 3-carbazol-9-yl-N-methyl-N-phenylaniline?
The InChIKey is JNEVDSTWXTVKOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2/c1-26(19-10-3-2-4-11-19)20-12-9-13-21(18-20)27-24-16-7-5-14-22(24)23-15-6-8-17-25(23)27/h2-18H,1H3.
What are the key properties of 3-carbazol-9-yl-N-methyl-N-phenylaniline?
3-carbazol-9-yl-N-methyl-N-phenylaniline has a molecular weight of 348.45 g/mol, XLogP of 6.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-N-methyl-N-phenylaniline is sourced from PubChem (CID 59211086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).