N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline

C42H32N2 — CID 177100868

IUPACN,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline
SMILESc1ccc(-c2cccc3ccc4c(c5ccccc5n4CCc4ccccc4N(c4ccccc4)c4ccccc4)c23)cc1
InChIInChI=1S/C42H32N2/c1-4-15-31(16-5-1)36-24-14-18-33-27-28-40-42(41(33)36)37-23-11-13-26-39(37)43(40)30-29-32-17-10-12-25-38(32)44(34-19-6-2-7-20-34)35-21-8-3-9-22-35/h1-28H,29-30H2
InChIKeyVJFSOCDSVOKFJF-UHFFFAOYSA-N
MW564.73 g/mol
LogP11.33
Rot. Bonds7

About N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline

N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline (PubChem CID 177100868) has the molecular formula C42H32N2 and a molecular weight of 564.73 g/mol. Its IUPAC name is N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline.

Molecular Properties

Compound NameN,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline
PubChem CID177100868
Molecular FormulaC42H32N2
Molecular Weight564.73 g/mol
Exact Mass564.26
IUPAC NameN,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline
SMILESc1ccc(-c2cccc3ccc4c(c5ccccc5n4CCc4ccccc4N(c4ccccc4)c4ccccc4)c23)cc1
InChIInChI=1S/C42H32N2/c1-4-15-31(16-5-1)36-24-14-18-33-27-28-40-42(41(33)36)37-23-11-13-26-39(37)43(40)30-29-32-17-10-12-25-38(32)44(34-19-6-2-7-20-34)35-21-8-3-9-22-35/h1-28H,29-30H2
InChIKeyVJFSOCDSVOKFJF-UHFFFAOYSA-N
XLogP11.33
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500564.73
LogP ≤ 511.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-naphthalen-1-ylbenzo[c]carbazol-7-yl)-N-phenyl-N-(4-phenylphenyl)aniline
CID 177101055
5-(1-phenylbenzo[c]carbazol-7-yl)-N,N-bis(4-phenylphenyl)naphthalen-1-amine
CID 177100828
N-[4-(7-methylbenzo[c]carbazol-11-yl)phenyl]-N,4-diphenylaniline
CID 126631257
N-phenyl-N-[4-[4-[1-(2-phenylphenyl)benzo[c]carbazol-7-yl]phenyl]phenyl]naphthalen-1-amine
CID 177101002
2-naphthalen-1-yl-N-[4-[2-(1-phenylbenzo[c]carbazol-7-yl)phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 177101126
N,4-diphenyl-N-[4-(11-phenylbenzo[c]carbazol-7-yl)phenyl]aniline
CID 177101209
N-(4-naphthalen-1-ylphenyl)-N-[4-(8-phenylnaphthalen-1-yl)phenyl]naphthalen-1-amine
CID 140943779
N-(4-naphthalen-1-ylphenyl)-3-(1-phenylbenzo[c]carbazol-7-yl)-N-(4-phenylphenyl)aniline
CID 177100994
7-methyl-N,N-diphenylbenzo[c]carbazol-11-amine
CID 126631213
4-phenyl-N-[4-[5-(1-phenylbenzo[c]carbazol-7-yl)naphthalen-1-yl]phenyl]-N-(4-phenylphenyl)aniline
CID 177100999
N-(4-naphthalen-1-ylphenyl)-9-phenyl-N-[4-(8-phenylnaphthalen-1-yl)phenyl]carbazol-4-amine
CID 168835696
N,4-diphenyl-N-[4-[1-(2-phenylphenyl)benzo[c]carbazol-7-yl]phenyl]aniline
CID 177100985

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline?
The IUPAC name of N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline (CID 177100868) is N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline.
What is the SMILES notation for N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline?
The canonical SMILES for N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline is c1ccc(-c2cccc3ccc4c(c5ccccc5n4CCc4ccccc4N(c4ccccc4)c4ccccc4)c23)cc1.
What is the InChIKey of N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline?
The InChIKey is VJFSOCDSVOKFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H32N2/c1-4-15-31(16-5-1)36-24-14-18-33-27-28-40-42(41(33)36)37-23-11-13-26-39(37)43(40)30-29-32-17-10-12-25-38(32)44(34-19-6-2-7-20-34)35-21-8-3-9-22-35/h1-28H,29-30H2.
What are the key properties of N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline?
N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline has a molecular weight of 564.73 g/mol, XLogP of 11.33, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-2-[2-(1-phenylbenzo[c]carbazol-7-yl)ethyl]aniline is sourced from PubChem (CID 177100868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).