N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine

C41H30N2 — CID 118282615

IUPACN-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine
SMILESCc1cccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc23)c1
InChIInChI=1S/C41H30N2/c1-29-13-12-18-33(27-29)42(31-14-4-2-5-15-31)40-26-24-34(35-19-8-9-20-36(35)40)30-23-25-41-38(28-30)37-21-10-11-22-39(37)43(41)32-16-6-3-7-17-32/h2-28H,1H3
InChIKeyLZTXKOLCLONMDZ-UHFFFAOYSA-N
MW550.71 g/mol
LogP11.38
Rot. Bonds5

About N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine

N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine (PubChem CID 118282615) has the molecular formula C41H30N2 and a molecular weight of 550.71 g/mol. Its IUPAC name is N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine.

Molecular Properties

Compound NameN-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine
PubChem CID118282615
Molecular FormulaC41H30N2
Molecular Weight550.71 g/mol
Exact Mass550.24
IUPAC NameN-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine
SMILESCc1cccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc23)c1
InChIInChI=1S/C41H30N2/c1-29-13-12-18-33(27-29)42(31-14-4-2-5-15-31)40-26-24-34(35-19-8-9-20-36(35)40)30-23-25-41-38(28-30)37-21-10-11-22-39(37)43(41)32-16-6-3-7-17-32/h2-28H,1H3
InChIKeyLZTXKOLCLONMDZ-UHFFFAOYSA-N
XLogP11.38
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 ≤ 511.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-carbazol-9-ylphenyl)-4-(9-phenylcarbazol-3-yl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-1-amine
CID 71038259
N,N-bis(4-methylphenyl)-9-[3-[3-(N-(4-phenylnaphthalen-1-yl)anilino)carbazol-9-yl]phenyl]carbazol-3-amine
CID 163999771
ethane;N-phenyl-5-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)naphthalen-1-amine
CID 143813910
4-(9-phenylcarbazol-2-yl)-N,N-bis[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]naphthalen-1-amine;4-[4-(9-phenylcarbazol-3-yl)phenyl]-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]aniline
CID 158955630
4-(9-phenylcarbazol-3-yl)-N-[4-(9-phenylcarbazol-2-yl)naphthalen-1-yl]-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]naphthalen-1-amine;4-(9-phenylcarbazol-2-yl)-N-[4-[4-(9-phenylcarbazol-2-yl)phenyl]phenyl]-N-[4-[4-(9-phenylcarbazol-3-yl)phenyl]phenyl]naphthalen-1-amine
CID 157357490
4-[9-[4-(4-carbazol-9-yl-N-(4-carbazol-9-ylphenyl)anilino)phenyl]carbazol-3-yl]-N-[4-[4-(N-naphthalen-1-ylanilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
CID 130397476
N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-[4-[7-[3-[3-[4-[N-(4-carbazol-9-ylphenyl)-4-(9-phenylcarbazol-3-yl)anilino]naphthalen-1-yl]carbazol-9-yl]phenyl]-9-phenylcarbazol-3-yl]phenyl]-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine
CID 138506678
N,N,2-triphenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 142704370
N-(4-methylphenyl)-N-[4-[4-(N-naphthalen-2-ylanilino)naphthalen-1-yl]phenyl]-9-phenylcarbazol-3-amine
CID 59181394
9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazole;4-N-(3-methylphenyl)-1-N,1-N-bis[4-(N-(3-methylphenyl)anilino)phenyl]-4-N-phenylbenzene-1,4-diamine
CID 159948060
N,N-bis(4-methylphenyl)-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;N,N-diphenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]aniline;4-[6-(6-methyl-9-phenylcarbazol-3-yl)-9-phenylcarbazol-3-yl]-N,N-diphenylaniline
CID 159011512
3-methyl-N-phenyl-N-[4-[9-[4-(10-phenylanthracen-9-yl)phenyl]carbazol-3-yl]phenyl]aniline
CID 59307122

Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine?
The IUPAC name of N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine (CID 118282615) is N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine.
What is the SMILES notation for N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine?
The canonical SMILES for N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine is Cc1cccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3ccccc23)c1.
What is the InChIKey of N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine?
The InChIKey is LZTXKOLCLONMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H30N2/c1-29-13-12-18-33(27-29)42(31-14-4-2-5-15-31)40-26-24-34(35-19-8-9-20-36(35)40)30-23-25-41-38(28-30)37-21-10-11-22-39(37)43(41)32-16-6-3-7-17-32/h2-28H,1H3.
What are the key properties of N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine?
N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine has a molecular weight of 550.71 g/mol, XLogP of 11.38, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)-N-phenyl-4-(9-phenylcarbazol-3-yl)naphthalen-1-amine is sourced from PubChem (CID 118282615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).