N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine

C44H30N2 — CID 165006232

IUPACN-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine
SMILESc1ccc(-c2ccc(N(c3ccc4ccccc4c3)c3cccc4c3ccc3c4c4ccccc4n3-c3ccccc3)cc2)cc1
InChIInChI=1S/C44H30N2/c1-3-12-31(13-4-1)33-22-25-36(26-23-33)45(37-27-24-32-14-7-8-15-34(32)30-37)41-21-11-19-39-38(41)28-29-43-44(39)40-18-9-10-20-42(40)46(43)35-16-5-2-6-17-35/h1-30H
InChIKeyXDNSHKIYYRVWPU-UHFFFAOYSA-N
MW586.74 g/mol
LogP12.23
Rot. Bonds5

About N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine

N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine (PubChem CID 165006232) has the molecular formula C44H30N2 and a molecular weight of 586.74 g/mol. Its IUPAC name is N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine.

Molecular Properties

Compound NameN-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine
PubChem CID165006232
Molecular FormulaC44H30N2
Molecular Weight586.74 g/mol
Exact Mass586.24
IUPAC NameN-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine
SMILESc1ccc(-c2ccc(N(c3ccc4ccccc4c3)c3cccc4c3ccc3c4c4ccccc4n3-c3ccccc3)cc2)cc1
InChIInChI=1S/C44H30N2/c1-3-12-31(13-4-1)33-22-25-36(26-23-33)45(37-27-24-32-14-7-8-15-34(32)30-37)41-21-11-19-39-38(41)28-29-43-44(39)40-18-9-10-20-42(40)46(43)35-16-5-2-6-17-35/h1-30H
InChIKeyXDNSHKIYYRVWPU-UHFFFAOYSA-N
XLogP12.23
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500586.74
LogP ≤ 512.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-4-amine
CID 174258250
N,9-diphenyl-N-[6-(6-phenylnaphthalen-2-yl)naphthalen-2-yl]carbazol-4-amine
CID 174257716
7-phenyl-N-(2-phenylphenyl)-N-[4-(4-phenylphenyl)phenyl]benzo[c]carbazol-2-amine
CID 155034262
N-[4-[4-(dinaphthalen-1-ylamino)phenyl]phenyl]-N-naphthalen-1-ylnaphthalen-1-amine;N-[4-[4-(dinaphthalen-2-ylamino)phenyl]phenyl]-N-naphthalen-2-ylnaphthalen-2-amine;N,N-diphenyl-4-[4-(N-phenylanilino)phenyl]aniline;9-phenylcarbazole
CID 158239659
N-naphthalen-2-yl-N-[4-[4-(N-naphthalen-1-yl-4-phenylanilino)phenyl]naphthalen-1-yl]-9-phenylcarbazol-3-amine
CID 59181361
2-phenyl-N-[4-(7-phenylbenzo[c]carbazol-4-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 166847633
benzene;N-naphthalen-2-yl-N-[4-[5-(4-phenylphenyl)indolo[3,2-c]carbazol-12-yl]phenyl]naphthalen-2-amine
CID 145273265
N-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-N-phenylcarbazol-2-amine;N-phenyl-N,9-bis(4-phenylphenyl)carbazol-4-amine
CID 160619067
N-[4-[2-(9-phenylcarbazol-4-yl)carbazol-9-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 118034825
N-naphthalen-2-yl-6,11-diphenyl-N-(4-phenylphenyl)benzo[a]carbazol-7-amine
CID 174307834
N-(4-naphthalen-2-ylphenyl)-6-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 166956432
3-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N,3-N-diphenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 129256040

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine?
The IUPAC name of N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine (CID 165006232) is N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine.
What is the SMILES notation for N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine?
The canonical SMILES for N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine is c1ccc(-c2ccc(N(c3ccc4ccccc4c3)c3cccc4c3ccc3c4c4ccccc4n3-c3ccccc3)cc2)cc1.
What is the InChIKey of N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine?
The InChIKey is XDNSHKIYYRVWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H30N2/c1-3-12-31(13-4-1)33-22-25-36(26-23-33)45(37-27-24-32-14-7-8-15-34(32)30-37)41-21-11-19-39-38(41)28-29-43-44(39)40-18-9-10-20-42(40)46(43)35-16-5-2-6-17-35/h1-30H.
What are the key properties of N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine?
N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine has a molecular weight of 586.74 g/mol, XLogP of 12.23, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-7-phenyl-N-(4-phenylphenyl)benzo[c]carbazol-4-amine is sourced from PubChem (CID 165006232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).