9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine

C29H21N3 — CID 90231001

IUPAC9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine
SMILESNc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)nc(-c2ccccc2)c1
InChIInChI=1S/C29H21N3/c30-22-15-16-29-25(17-22)24-13-7-8-14-28(24)32(29)23-18-26(20-9-3-1-4-10-20)31-27(19-23)21-11-5-2-6-12-21/h1-19H,30H2
InChIKeyANUHOLQEIKKERH-UHFFFAOYSA-N
MW411.51 g/mol
LogP7.09
Rot. Bonds3

About 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine

9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine (PubChem CID 90231001) has the molecular formula C29H21N3 and a molecular weight of 411.51 g/mol. Its IUPAC name is 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine.

Molecular Properties

Compound Name9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine
PubChem CID90231001
Molecular FormulaC29H21N3
Molecular Weight411.51 g/mol
Exact Mass411.17
IUPAC Name9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine
SMILESNc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)nc(-c2ccccc2)c1
InChIInChI=1S/C29H21N3/c30-22-15-16-29-25(17-22)24-13-7-8-14-28(24)32(29)23-18-26(20-9-3-1-4-10-20)31-27(19-23)21-11-5-2-6-12-21/h1-19H,30H2
InChIKeyANUHOLQEIKKERH-UHFFFAOYSA-N
XLogP7.09
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500411.51
LogP ≤ 57.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

9-[3-[3-carbazol-9-yl-5-(2,6-diphenyl-4-pyridinyl)phenyl]-5-(2,6-diphenyl-4-pyridinyl)phenyl]carbazole
CID 58693128
11-phenyl-12-[2-phenyl-6-(9-phenylcarbazol-3-yl)-4-pyridinyl]indolo[2,3-a]carbazole
CID 118041109
3-(2,6-diphenyl-4-pyridinyl)-9-phenylcarbazole
CID 70934573
9-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-5-phenylphenyl]carbazole
CID 58943750
7-(2,6-diphenyl-4-pyridinyl)benzo[c]carbazole
CID 70836984
9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-3-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-3-yl]carbazole
CID 140923164
3-[9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-9-phenylcarbazole
CID 71286913
9-[3-carbazol-9-yl-5-[4-[6-(4-carbazol-9-ylphenyl)-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole
CID 58526987
3-carbazol-9-yl-9-[4-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]phenyl]carbazole
CID 126730416
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-5-phenylphenyl]phenyl]carbazole
CID 58943692
9-(2,6-diphenyl-4-pyridinyl)-2-(3-methylphenyl)carbazole
CID 145333962
3-[9-(2,6-diphenyl-4-pyridinyl)carbazol-3-yl]-9-phenylcarbazole;4-[9-(2,6-diphenyl-4-pyridinyl)carbazol-4-yl]-9-phenylcarbazole
CID 158283831

Frequently Asked Questions

What is the IUPAC name of 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine?
The IUPAC name of 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine (CID 90231001) is 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine.
What is the SMILES notation for 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine?
The canonical SMILES for 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine is Nc1ccc2c(c1)c1ccccc1n2-c1cc(-c2ccccc2)nc(-c2ccccc2)c1.
What is the InChIKey of 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine?
The InChIKey is ANUHOLQEIKKERH-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H21N3/c30-22-15-16-29-25(17-22)24-13-7-8-14-28(24)32(29)23-18-26(20-9-3-1-4-10-20)31-27(19-23)21-11-5-2-6-12-21/h1-19H,30H2.
What are the key properties of 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine?
9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine has a molecular weight of 411.51 g/mol, XLogP of 7.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2,6-diphenyl-4-pyridinyl)carbazol-3-amine is sourced from PubChem (CID 90231001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).