4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane

C32H28N2 — CID 144639434

IUPAC4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane
SMILESCC.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4[nH]c5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C30H22N2.C2H6/c1-3-9-24(10-4-1)32(25-11-5-2-6-12-25)26-18-15-22(16-19-26)23-17-20-30-28(21-23)27-13-7-8-14-29(27)31-30;1-2/h1-21,31H;1-2H3
InChIKeyHIRGODDTZNFDDJ-UHFFFAOYSA-N
MW440.59 g/mol
LogP9.48
Rot. Bonds4

About 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane

4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane (PubChem CID 144639434) has the molecular formula C32H28N2 and a molecular weight of 440.59 g/mol. Its IUPAC name is 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane.

Molecular Properties

Compound Name4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane
PubChem CID144639434
Molecular FormulaC32H28N2
Molecular Weight440.59 g/mol
Exact Mass440.23
IUPAC Name4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane
SMILESCC.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4[nH]c5ccccc5c4c3)cc2)cc1
InChIInChI=1S/C30H22N2.C2H6/c1-3-9-24(10-4-1)32(25-11-5-2-6-12-25)26-18-15-22(16-19-26)23-17-20-30-28(21-23)27-13-7-8-14-29(27)31-30;1-2/h1-21,31H;1-2H3
InChIKeyHIRGODDTZNFDDJ-UHFFFAOYSA-N
XLogP9.48
TPSA19.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.59
LogP ≤ 59.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

bromoethane;4-(9H-carbazol-3-yl)-N,N-diphenylaniline
CID 144639430
N-[4-(9H-carbazol-3-yl)phenyl]-N-phenyl-4-propylaniline
CID 59306714
N-[4-(9H-carbazol-3-yl)phenyl]-N-phenyl-3-propan-2-ylaniline
CID 59307180
N-[4-(9H-carbazol-3-yl)phenyl]-9,9-dimethyl-N-phenylfluoren-2-amine
CID 59306861
4-[4-[4-[4-(9H-carbazol-3-yl)phenyl]phenyl]phenyl]-N,N-bis(4-naphthalen-1-ylphenyl)aniline
CID 153492707
9H-carbazole;bis(N,N-diphenylaniline)
CID 174838898
6,7-dimethyl-N-phenyl-N-(4-phenylphenyl)-9H-carbazol-3-amine
CID 143420423
N-[2-(9H-carbazol-3-yl)phenyl]-N,2-diphenylaniline
CID 148771233
benzene;ethane;3-(4-methylphenyl)-6-phenyl-9H-carbazole
CID 143905034
N,N-diphenyl-3-[3-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-3-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;N,N-diphenyl-4-[4-[4-(N-phenylanilino)phenyl]phenyl]aniline;N,N-diphenyl-4-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]aniline;ethane
CID 159114076
3-(4-tert-butylphenyl)-9H-carbazole
CID 91473096
N-phenyl-N-[4-[6-[4-[N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenyl]-9H-carbazol-3-yl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 59306973

Frequently Asked Questions

What is the IUPAC name of 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane?
The IUPAC name of 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane (CID 144639434) is 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane.
What is the SMILES notation for 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane?
The canonical SMILES for 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane is CC.c1ccc(N(c2ccccc2)c2ccc(-c3ccc4[nH]c5ccccc5c4c3)cc2)cc1.
What is the InChIKey of 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane?
The InChIKey is HIRGODDTZNFDDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H22N2.C2H6/c1-3-9-24(10-4-1)32(25-11-5-2-6-12-25)26-18-15-22(16-19-26)23-17-20-30-28(21-23)27-13-7-8-14-29(27)31-30;1-2/h1-21,31H;1-2H3.
What are the key properties of 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane?
4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane has a molecular weight of 440.59 g/mol, XLogP of 9.48, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane is sourced from PubChem (CID 144639434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).