N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline

C41H30N2 — CID 126631250

IUPACN-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline
SMILESCN(c1ccccc1)c1ccc(-c2cccc3c2c2c4ccccc4ccc2n3-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C41H30N2/c1-42(33-14-6-3-7-15-33)34-24-21-32(22-25-34)37-17-10-18-38-40(37)41-36-16-9-8-13-31(36)23-28-39(41)43(38)35-26-19-30(20-27-35)29-11-4-2-5-12-29/h2-28H,1H3
InChIKeyNCXJXIKCQOAJKD-UHFFFAOYSA-N
MW550.71 g/mol
LogP11.04
Rot. Bonds5

About N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline

N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline (PubChem CID 126631250) has the molecular formula C41H30N2 and a molecular weight of 550.71 g/mol. Its IUPAC name is N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline.

Molecular Properties

Compound NameN-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline
PubChem CID126631250
Molecular FormulaC41H30N2
Molecular Weight550.71 g/mol
Exact Mass550.24
IUPAC NameN-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline
SMILESCN(c1ccccc1)c1ccc(-c2cccc3c2c2c4ccccc4ccc2n3-c2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C41H30N2/c1-42(33-14-6-3-7-15-33)34-24-21-32(22-25-34)37-17-10-18-38-40(37)41-36-16-9-8-13-31(36)23-28-39(41)43(38)35-26-19-30(20-27-35)29-11-4-2-5-12-29/h2-28H,1H3
InChIKeyNCXJXIKCQOAJKD-UHFFFAOYSA-N
XLogP11.04
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500550.71
LogP ≤ 511.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-diphenyl-N-[4-(11-phenylbenzo[c]carbazol-7-yl)phenyl]aniline
CID 177101209
N-(4-naphthalen-1-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]-3-(7-phenylbenzo[c]carbazol-11-yl)aniline
CID 166660520
N-(4-naphthalen-1-ylphenyl)-3-(7-phenylbenzo[c]carbazol-11-yl)-N-[4-(4-phenylphenyl)phenyl]aniline
CID 167196262
3-(7-phenylbenzo[c]carbazol-11-yl)-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]aniline
CID 166660559
N-[4-(3,5-diphenylphenyl)phenyl]-3-(7-phenylbenzo[c]carbazol-11-yl)-N-(4-phenylphenyl)aniline
CID 166660549
N-(4-naphthalen-1-ylphenyl)-N-phenyl-3-(7-phenylbenzo[c]carbazol-11-yl)aniline
CID 167195951
4-[4-(12-azapentacyclo[11.8.0.02,11.03,8.016,21]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaen-12-yl)phenyl]-N,N-diphenylaniline;ethane
CID 144741395
N-[4-(7-methylbenzo[c]carbazol-11-yl)phenyl]-N,4-diphenylaniline
CID 126631257
N,N-bis(4-naphthalen-2-ylphenyl)-3-(7-phenylbenzo[c]carbazol-11-yl)aniline
CID 166659643
N-methyl-N-phenyl-4-[7-(3-phenylphenyl)benzo[c]carbazol-10-yl]aniline
CID 126631336
N-(4-phenanthren-2-ylphenyl)-N-phenyl-3-(7-phenylbenzo[c]carbazol-11-yl)aniline
CID 167196251
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-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline?
The IUPAC name of N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline (CID 126631250) is N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline.
What is the SMILES notation for N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline?
The canonical SMILES for N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline is CN(c1ccccc1)c1ccc(-c2cccc3c2c2c4ccccc4ccc2n3-c2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline?
The InChIKey is NCXJXIKCQOAJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H30N2/c1-42(33-14-6-3-7-15-33)34-24-21-32(22-25-34)37-17-10-18-38-40(37)41-36-16-9-8-13-31(36)23-28-39(41)43(38)35-26-19-30(20-27-35)29-11-4-2-5-12-29/h2-28H,1H3.
What are the key properties of N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline?
N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline has a molecular weight of 550.71 g/mol, XLogP of 11.04, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-4-[7-(4-phenylphenyl)benzo[c]carbazol-11-yl]aniline is sourced from PubChem (CID 126631250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).