9H-carbazole;N,N-diphenylaniline;pyridine

C35H29N3 — CID 175394994

IUPAC9H-carbazole;N,N-diphenylaniline;pyridine
SMILESc1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)[nH]c1ccccc12.c1ccncc1
InChIInChI=1S/C18H15N.C12H9N.C5H5N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-6-5-3-1/h1-15H;1-8,13H;1-5H
InChIKeyGYVWCLXWCPHYII-UHFFFAOYSA-N
MW491.64 g/mol
LogP9.56
Rot. Bonds3

About 9H-carbazole;N,N-diphenylaniline;pyridine

9H-carbazole;N,N-diphenylaniline;pyridine (PubChem CID 175394994) has the molecular formula C35H29N3 and a molecular weight of 491.64 g/mol. Its IUPAC name is 9H-carbazole;N,N-diphenylaniline;pyridine.

Molecular Properties

Compound Name9H-carbazole;N,N-diphenylaniline;pyridine
PubChem CID175394994
Molecular FormulaC35H29N3
Molecular Weight491.64 g/mol
Exact Mass491.24
IUPAC Name9H-carbazole;N,N-diphenylaniline;pyridine
SMILESc1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)[nH]c1ccccc12.c1ccncc1
InChIInChI=1S/C18H15N.C12H9N.C5H5N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-6-5-3-1/h1-15H;1-8,13H;1-5H
InChIKeyGYVWCLXWCPHYII-UHFFFAOYSA-N
XLogP9.56
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500491.64
LogP ≤ 59.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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9H-carbazole;1H-indole;pyridine
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9H-carbazole
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N,N-diphenylaniline;1H-pyrazole;pyridine
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4-(9H-carbazol-3-yl)-N,N-diphenylaniline;ethane
CID 144639434
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437
bromoethane;4-(9H-carbazol-3-yl)-N,N-diphenylaniline
CID 144639430
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CID 175041243
bis(9H-carbazole);propane
CID 90987002

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;N,N-diphenylaniline;pyridine?
The IUPAC name of 9H-carbazole;N,N-diphenylaniline;pyridine (CID 175394994) is 9H-carbazole;N,N-diphenylaniline;pyridine.
What is the SMILES notation for 9H-carbazole;N,N-diphenylaniline;pyridine?
The canonical SMILES for 9H-carbazole;N,N-diphenylaniline;pyridine is c1ccc(N(c2ccccc2)c2ccccc2)cc1.c1ccc2c(c1)[nH]c1ccccc12.c1ccncc1.
What is the InChIKey of 9H-carbazole;N,N-diphenylaniline;pyridine?
The InChIKey is GYVWCLXWCPHYII-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N.C12H9N.C5H5N/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-2-4-6-5-3-1/h1-15H;1-8,13H;1-5H.
What are the key properties of 9H-carbazole;N,N-diphenylaniline;pyridine?
9H-carbazole;N,N-diphenylaniline;pyridine has a molecular weight of 491.64 g/mol, XLogP of 9.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;N,N-diphenylaniline;pyridine is sourced from PubChem (CID 175394994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).