3-(2-methylcarbazol-9-yl)aniline

C19H16N2 — CID 168798283

IUPAC3-(2-methylcarbazol-9-yl)aniline
SMILESCc1ccc2c3ccccc3n(-c3cccc(N)c3)c2c1
InChIInChI=1S/C19H16N2/c1-13-9-10-17-16-7-2-3-8-18(16)21(19(17)11-13)15-6-4-5-14(20)12-15/h2-12H,20H2,1H3
InChIKeyKEDJYLZNYYQDEW-UHFFFAOYSA-N
MW272.35 g/mol
LogP4.67
Rot. Bonds1

About 3-(2-methylcarbazol-9-yl)aniline

3-(2-methylcarbazol-9-yl)aniline (PubChem CID 168798283) has the molecular formula C19H16N2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 3-(2-methylcarbazol-9-yl)aniline.

Molecular Properties

Compound Name3-(2-methylcarbazol-9-yl)aniline
PubChem CID168798283
Molecular FormulaC19H16N2
Molecular Weight272.35 g/mol
Exact Mass272.13
IUPAC Name3-(2-methylcarbazol-9-yl)aniline
SMILESCc1ccc2c3ccccc3n(-c3cccc(N)c3)c2c1
InChIInChI=1S/C19H16N2/c1-13-9-10-17-16-7-2-3-8-18(16)21(19(17)11-13)15-6-4-5-14(20)12-15/h2-12H,20H2,1H3
InChIKeyKEDJYLZNYYQDEW-UHFFFAOYSA-N
XLogP4.67
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

9-(3-carbazol-9-ylphenyl)-3-(2-methylcarbazol-9-yl)carbazole
CID 170201856
2-methyl-9-phenylcarbazole
CID 59552741
2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159508303
9-(3-carbazol-9-ylphenyl)carbazole;9-(4-carbazol-9-ylphenyl)carbazole;3,6-dimethyl-9-phenylcarbazole;ethane;2-methyl-9-phenylcarbazole;3-methyl-9-phenylcarbazole
CID 159290394
9-[3-(3-carbazol-9-ylphenyl)phenyl]carbazole;9-[3-[3-(3,6-dimethylcarbazol-9-yl)phenyl]phenyl]-3,6-dimethylcarbazole;2-methyl-9-[3-(2-methylcarbazol-9-yl)phenyl]carbazole;3-methyl-9-[3-[3-(3-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 160993744
3-methyl-9-[3-(3-methylcarbazol-9-yl)phenyl]carbazole
CID 59399075
ethane;9-(3-methylphenyl)carbazole
CID 143904684
3-carbazol-9-yl-6-methyl-9-phenylcarbazole;2-(3-methylcarbazol-9-yl)-9-phenylcarbazole
CID 158584509
3-(3-phenylpyrrolo[3,2-b]carbazol-9-yl)aniline
CID 90062777
9-(4-fluorophenyl)-2-methylcarbazole
CID 148964710
9-[4-[2-(4-carbazol-9-ylphenyl)ethynyl]phenyl]-2,7-dimethylcarbazole
CID 58771348
3-[9-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-2-methylcarbazol-3-yl]-2-methyl-9-[3-methyl-4-[2-methyl-4-(2-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 23397785

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcarbazol-9-yl)aniline?
The IUPAC name of 3-(2-methylcarbazol-9-yl)aniline (CID 168798283) is 3-(2-methylcarbazol-9-yl)aniline.
What is the SMILES notation for 3-(2-methylcarbazol-9-yl)aniline?
The canonical SMILES for 3-(2-methylcarbazol-9-yl)aniline is Cc1ccc2c3ccccc3n(-c3cccc(N)c3)c2c1.
What is the InChIKey of 3-(2-methylcarbazol-9-yl)aniline?
The InChIKey is KEDJYLZNYYQDEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2/c1-13-9-10-17-16-7-2-3-8-18(16)21(19(17)11-13)15-6-4-5-14(20)12-15/h2-12H,20H2,1H3.
What are the key properties of 3-(2-methylcarbazol-9-yl)aniline?
3-(2-methylcarbazol-9-yl)aniline has a molecular weight of 272.35 g/mol, XLogP of 4.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcarbazol-9-yl)aniline is sourced from PubChem (CID 168798283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).