N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline

C40H28N2 — CID 169285498

IUPACN-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline
SMILESc1ccc(-c2cccc3cccc(-c4ccc(Nc5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c23)cc1
InChIInChI=1S/C40H28N2/c1-2-10-28(11-3-1)34-16-8-12-30-13-9-17-35(40(30)34)29-20-22-31(23-21-29)41-32-24-26-33(27-25-32)42-38-18-6-4-14-36(38)37-15-5-7-19-39(37)42/h1-27,41H
InChIKeyCVDHDUJUZYVLQW-UHFFFAOYSA-N
MW536.68 g/mol
LogP11.01
Rot. Bonds5

About N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline

N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline (PubChem CID 169285498) has the molecular formula C40H28N2 and a molecular weight of 536.68 g/mol. Its IUPAC name is N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline.

Molecular Properties

Compound NameN-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline
PubChem CID169285498
Molecular FormulaC40H28N2
Molecular Weight536.68 g/mol
Exact Mass536.23
IUPAC NameN-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline
SMILESc1ccc(-c2cccc3cccc(-c4ccc(Nc5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c23)cc1
InChIInChI=1S/C40H28N2/c1-2-10-28(11-3-1)34-16-8-12-30-13-9-17-35(40(30)34)29-20-22-31(23-21-29)41-32-24-26-33(27-25-32)42-38-18-6-4-14-36(38)37-15-5-7-19-39(37)42/h1-27,41H
InChIKeyCVDHDUJUZYVLQW-UHFFFAOYSA-N
XLogP11.01
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.68
LogP ≤ 511.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[2-(4-carbazol-9-ylphenyl)phenyl]phenyl]-4-phenylaniline
CID 134380568
9-phenyl-N-[3-(8-phenylnaphthalen-1-yl)phenyl]carbazol-2-amine
CID 169028754
4-(4-carbazol-9-ylphenyl)-N,N-bis[4-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170379939
4-[8-(4-carbazol-9-ylphenyl)naphthalen-1-yl]-N,N-diphenylaniline
CID 169016142
N-(4-carbazol-9-ylphenyl)-N-[4-(8-phenylnaphthalen-1-yl)phenyl]-4-(3-phenylphenyl)aniline
CID 168798243
4-(4-naphthalen-1-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 59282038
N-(4-carbazol-9-ylphenyl)-N-phenyl-4-[3-(8-phenylnaphthalen-1-yl)phenyl]aniline
CID 170380154
N-(4-carbazol-9-ylphenyl)-4-(8-naphthalen-1-ylnaphthalen-1-yl)-N-phenylaniline
CID 170380175
9-[4-[8-(4-pyrimidin-5-ylphenyl)naphthalen-1-yl]phenyl]carbazole
CID 121286038
5-(4-phenylphenyl)-5-azaheptacyclo[19.7.1.02,14.04,12.06,11.015,20.025,29]nonacosa-1(28),2(14),3,6,8,10,12,15,17,19,21,23,25(29),26-tetradecaene
CID 155771619
9-[4-[4-naphthalen-2-yl-6-[3-(8-phenylnaphthalen-1-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 177283094
23-[4-(10-phenylanthracen-9-yl)phenyl]-23-azahexacyclo[12.7.1.16,9.02,7.08,13.018,22]tricosa-1(21),2(7),3,5,8(13),9,11,14,16,18(22),19-undecaene
CID 155429764

Frequently Asked Questions

What is the IUPAC name of N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline?
The IUPAC name of N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline (CID 169285498) is N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline.
What is the SMILES notation for N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline?
The canonical SMILES for N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline is c1ccc(-c2cccc3cccc(-c4ccc(Nc5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c23)cc1.
What is the InChIKey of N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline?
The InChIKey is CVDHDUJUZYVLQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H28N2/c1-2-10-28(11-3-1)34-16-8-12-30-13-9-17-35(40(30)34)29-20-22-31(23-21-29)41-32-24-26-33(27-25-32)42-38-18-6-4-14-36(38)37-15-5-7-19-39(37)42/h1-27,41H.
What are the key properties of N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline?
N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline has a molecular weight of 536.68 g/mol, XLogP of 11.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbazol-9-ylphenyl)-4-(8-phenylnaphthalen-1-yl)aniline is sourced from PubChem (CID 169285498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).