2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline

C25H20N2 — CID 137483229

IUPAC2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1ccccc1-c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C25H20N2/c1-27(19-9-3-2-4-10-19)25-14-8-6-11-20(25)18-15-16-22-21-12-5-7-13-23(21)26-24(22)17-18/h2-17,26H,1H3
InChIKeyPJQZCEDBSMMWRN-UHFFFAOYSA-N
MW348.45 g/mol
LogP6.76
Rot. Bonds3

About 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline

2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline (PubChem CID 137483229) has the molecular formula C25H20N2 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline.

Molecular Properties

Compound Name2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline
PubChem CID137483229
Molecular FormulaC25H20N2
Molecular Weight348.45 g/mol
Exact Mass348.16
IUPAC Name2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline
SMILESCN(c1ccccc1)c1ccccc1-c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C25H20N2/c1-27(19-9-3-2-4-10-19)25-14-8-6-11-20(25)18-15-16-22-21-12-5-7-13-23(21)26-24(22)17-18/h2-17,26H,1H3
InChIKeyPJQZCEDBSMMWRN-UHFFFAOYSA-N
XLogP6.76
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.45
LogP ≤ 56.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(9H-carbazol-3-yl)phenyl]-N,2-diphenylaniline
CID 148771233
N-methyl-2-[2-(N-methylanilino)phenyl]-N-phenylaniline
CID 132560477
2-(2,5-diphenylphenyl)-9H-carbazole
CID 177269985
2-(3-phenylphenyl)-9H-carbazole
CID 135143847
2-triphenylen-2-yl-9H-carbazole
CID 118922949
N-methyl-N,2-bis(4-phenylphenyl)aniline;propane
CID 145370298
2-(9H-carbazol-2-yl)benzene-1,4-diamine
CID 175102492
N-methyl-5-phenyl-N-(3-phenylphenyl)naphthalen-1-amine
CID 163451473
N-methyl-N-(3-naphthalen-2-ylphenyl)-2-phenylaniline
CID 163929020
2-(5H-benzo[b]phosphindol-4-yl)-9H-carbazole
CID 137483225
9H-carbazole;bis(N,N-diphenylaniline)
CID 174838898
4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane
CID 144639434

Frequently Asked Questions

What is the IUPAC name of 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline?
The IUPAC name of 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline (CID 137483229) is 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline.
What is the SMILES notation for 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline?
The canonical SMILES for 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline is CN(c1ccccc1)c1ccccc1-c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline?
The InChIKey is PJQZCEDBSMMWRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N2/c1-27(19-9-3-2-4-10-19)25-14-8-6-11-20(25)18-15-16-22-21-12-5-7-13-23(21)26-24(22)17-18/h2-17,26H,1H3.
What are the key properties of 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline?
2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline has a molecular weight of 348.45 g/mol, XLogP of 6.76, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9H-carbazol-2-yl)-N-methyl-N-phenylaniline is sourced from PubChem (CID 137483229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).