2-(2,5-dihydrocarbazol-9-yl)aniline

C18H16N2 — CID 135742580

IUPAC2-(2,5-dihydrocarbazol-9-yl)aniline
SMILESNc1ccccc1-n1c2c(c3c1=CC=CC3)C=CCC=2
InChIInChI=1S/C18H16N2/c19-15-9-3-6-12-18(15)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-4,6,8-12H,5,7,19H2
InChIKeyGAEMINOBWUSSQW-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.15
Rot. Bonds1

About 2-(2,5-dihydrocarbazol-9-yl)aniline

2-(2,5-dihydrocarbazol-9-yl)aniline (PubChem CID 135742580) has the molecular formula C18H16N2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(2,5-dihydrocarbazol-9-yl)aniline.

Molecular Properties

Compound Name2-(2,5-dihydrocarbazol-9-yl)aniline
PubChem CID135742580
Molecular FormulaC18H16N2
Molecular Weight260.34 g/mol
Exact Mass260.13
IUPAC Name2-(2,5-dihydrocarbazol-9-yl)aniline
SMILESNc1ccccc1-n1c2c(c3c1=CC=CC3)C=CCC=2
InChIInChI=1S/C18H16N2/c19-15-9-3-6-12-18(15)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-4,6,8-12H,5,7,19H2
InChIKeyGAEMINOBWUSSQW-UHFFFAOYSA-N
XLogP2.15
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dihydrocarbazol-9-yl)aniline?
The IUPAC name of 2-(2,5-dihydrocarbazol-9-yl)aniline (CID 135742580) is 2-(2,5-dihydrocarbazol-9-yl)aniline.
What is the SMILES notation for 2-(2,5-dihydrocarbazol-9-yl)aniline?
The canonical SMILES for 2-(2,5-dihydrocarbazol-9-yl)aniline is Nc1ccccc1-n1c2c(c3c1=CC=CC3)C=CCC=2.
What is the InChIKey of 2-(2,5-dihydrocarbazol-9-yl)aniline?
The InChIKey is GAEMINOBWUSSQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2/c19-15-9-3-6-12-18(15)20-16-10-4-1-7-13(16)14-8-2-5-11-17(14)20/h1-4,6,8-12H,5,7,19H2.
What are the key properties of 2-(2,5-dihydrocarbazol-9-yl)aniline?
2-(2,5-dihydrocarbazol-9-yl)aniline has a molecular weight of 260.34 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dihydrocarbazol-9-yl)aniline is sourced from PubChem (CID 135742580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).