2-carbazol-9-yl-N,N-diphenylaniline

C30H22N2 — CID 66650204

IUPAC2-carbazol-9-yl-N,N-diphenylaniline
SMILESc1ccc(N(c2ccccc2)c2ccccc2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C30H22N2/c1-3-13-23(14-4-1)31(24-15-5-2-6-16-24)29-21-11-12-22-30(29)32-27-19-9-7-17-25(27)26-18-8-10-20-28(26)32/h1-22H
InChIKeyRKVIAZWOECXCCM-UHFFFAOYSA-N
MW410.52 g/mol
LogP8.25
Rot. Bonds4

About 2-carbazol-9-yl-N,N-diphenylaniline

2-carbazol-9-yl-N,N-diphenylaniline (PubChem CID 66650204) has the molecular formula C30H22N2 and a molecular weight of 410.52 g/mol. Its IUPAC name is 2-carbazol-9-yl-N,N-diphenylaniline.

Molecular Properties

Compound Name2-carbazol-9-yl-N,N-diphenylaniline
PubChem CID66650204
Molecular FormulaC30H22N2
Molecular Weight410.52 g/mol
Exact Mass410.18
IUPAC Name2-carbazol-9-yl-N,N-diphenylaniline
SMILESc1ccc(N(c2ccccc2)c2ccccc2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C30H22N2/c1-3-13-23(14-4-1)31(24-15-5-2-6-16-24)29-21-11-12-22-30(29)32-27-19-9-7-17-25(27)26-18-8-10-20-28(26)32/h1-22H
InChIKeyRKVIAZWOECXCCM-UHFFFAOYSA-N
XLogP8.25
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.52
LogP ≤ 58.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-N,N-diphenylaniline?
The IUPAC name of 2-carbazol-9-yl-N,N-diphenylaniline (CID 66650204) is 2-carbazol-9-yl-N,N-diphenylaniline.
What is the SMILES notation for 2-carbazol-9-yl-N,N-diphenylaniline?
The canonical SMILES for 2-carbazol-9-yl-N,N-diphenylaniline is c1ccc(N(c2ccccc2)c2ccccc2-n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 2-carbazol-9-yl-N,N-diphenylaniline?
The InChIKey is RKVIAZWOECXCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N2/c1-3-13-23(14-4-1)31(24-15-5-2-6-16-24)29-21-11-12-22-30(29)32-27-19-9-7-17-25(27)26-18-8-10-20-28(26)32/h1-22H.
What are the key properties of 2-carbazol-9-yl-N,N-diphenylaniline?
2-carbazol-9-yl-N,N-diphenylaniline has a molecular weight of 410.52 g/mol, XLogP of 8.25, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-N,N-diphenylaniline is sourced from PubChem (CID 66650204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).