N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine

C42H29N3 — CID 90168095

IUPACN,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine
SMILESc1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C42H29N3/c1-4-14-30(15-5-1)43(31-16-6-2-7-17-31)33-24-26-42-37(28-33)36-21-11-13-23-40(36)45(42)34-25-27-41-38(29-34)35-20-10-12-22-39(35)44(41)32-18-8-3-9-19-32/h1-29H
InChIKeyPJPRCXULZYSDHS-UHFFFAOYSA-N
MW575.72 g/mol
LogP11.35
Rot. Bonds5

About N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine

N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine (PubChem CID 90168095) has the molecular formula C42H29N3 and a molecular weight of 575.72 g/mol. Its IUPAC name is N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine.

Molecular Properties

Compound NameN,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine
PubChem CID90168095
Molecular FormulaC42H29N3
Molecular Weight575.72 g/mol
Exact Mass575.24
IUPAC NameN,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine
SMILESc1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1
InChIInChI=1S/C42H29N3/c1-4-14-30(15-5-1)43(31-16-6-2-7-17-31)33-24-26-42-37(28-33)36-21-11-13-23-40(36)45(42)34-25-27-41-38(29-34)35-20-10-12-22-39(35)44(41)32-18-8-3-9-19-32/h1-29H
InChIKeyPJPRCXULZYSDHS-UHFFFAOYSA-N
XLogP11.35
TPSA13.10 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500575.72
LogP ≤ 511.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyl-9-(9-phenylcarbazol-3-yl)-N-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-3-amine
CID 59365518
N,9-diphenyl-N-[9-[4-[4-[4-[3-(N-(9-phenylcarbazol-3-yl)anilino)carbazol-9-yl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazol-3-amine
CID 172537472
N-[9-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]carbazol-3-yl]-N,9-diphenylcarbazol-3-amine
CID 172537557
N-(4-carbazol-9-ylphenyl)-N-phenyl-9-(4-phenylphenyl)carbazol-3-amine
CID 129061469
N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-[4-(N-phenylanilino)phenyl]anilino)phenyl]benzene-1,4-diamine
CID 159618005
N-(4-methylphenyl)-N,9-diphenylcarbazol-3-amine
CID 90181897
N,N-diphenyl-9-(5-phenylpyrido[4,3-b]indol-8-yl)carbazol-3-amine
CID 90168082
3-[2-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]-N,N-diphenylaniline
CID 170132805
3-carbazol-9-yl-9-methylcarbazole;4-carbazol-9-yl-N-methyl-N-phenylaniline;9-methyl-N,N-diphenylcarbazol-3-amine
CID 160890732
2-carbazol-9-yl-9-[4-[4-(2-carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]carbazole;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-2-yl)anilino)phenyl]phenyl]carbazol-2-amine;9-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine
CID 157469866
9-phenyl-N-(4-phenylphenyl)-N-[4-[4-(4-phenyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine
CID 58651963
2-N,2-N,6-N,6-N,9-N,9-N,10-N-heptakis-phenyl-10-N-(9-phenylcarbazol-3-yl)anthracene-2,6,9,10-tetramine
CID 172546753

Frequently Asked Questions

What is the IUPAC name of N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine?
The IUPAC name of N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine (CID 90168095) is N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine.
What is the SMILES notation for N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine?
The canonical SMILES for N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine is c1ccc(N(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.
What is the InChIKey of N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine?
The InChIKey is PJPRCXULZYSDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H29N3/c1-4-14-30(15-5-1)43(31-16-6-2-7-17-31)33-24-26-42-37(28-33)36-21-11-13-23-40(36)45(42)34-25-27-41-38(29-34)35-20-10-12-22-39(35)44(41)32-18-8-3-9-19-32/h1-29H.
What are the key properties of N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine?
N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine has a molecular weight of 575.72 g/mol, XLogP of 11.35, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diphenyl-9-(9-phenylcarbazol-3-yl)carbazol-3-amine is sourced from PubChem (CID 90168095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).