9-[(4-chlorophenyl)methyl]carbazole

C19H14ClN — CID 15206746

IUPAC9-[(4-chlorophenyl)methyl]carbazole
SMILESClc1ccc(Cn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H14ClN/c20-15-11-9-14(10-12-15)13-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-12H,13H2
InChIKeyYKTHZSAUJYVBFY-UHFFFAOYSA-N
MW291.78 g/mol
LogP5.50
Rot. Bonds2

About 9-[(4-chlorophenyl)methyl]carbazole

9-[(4-chlorophenyl)methyl]carbazole (PubChem CID 15206746) has the molecular formula C19H14ClN and a molecular weight of 291.78 g/mol. Its IUPAC name is 9-[(4-chlorophenyl)methyl]carbazole.

Molecular Properties

Compound Name9-[(4-chlorophenyl)methyl]carbazole
PubChem CID15206746
Molecular FormulaC19H14ClN
Molecular Weight291.78 g/mol
Exact Mass291.08
IUPAC Name9-[(4-chlorophenyl)methyl]carbazole
SMILESClc1ccc(Cn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C19H14ClN/c20-15-11-9-14(10-12-15)13-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-12H,13H2
InChIKeyYKTHZSAUJYVBFY-UHFFFAOYSA-N
XLogP5.50
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500291.78
LogP ≤ 55.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-[(4-chlorophenyl)methyl]carbazole?
The IUPAC name of 9-[(4-chlorophenyl)methyl]carbazole (CID 15206746) is 9-[(4-chlorophenyl)methyl]carbazole.
What is the SMILES notation for 9-[(4-chlorophenyl)methyl]carbazole?
The canonical SMILES for 9-[(4-chlorophenyl)methyl]carbazole is Clc1ccc(Cn2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 9-[(4-chlorophenyl)methyl]carbazole?
The InChIKey is YKTHZSAUJYVBFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClN/c20-15-11-9-14(10-12-15)13-21-18-7-3-1-5-16(18)17-6-2-4-8-19(17)21/h1-12H,13H2.
What are the key properties of 9-[(4-chlorophenyl)methyl]carbazole?
9-[(4-chlorophenyl)methyl]carbazole has a molecular weight of 291.78 g/mol, XLogP of 5.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(4-chlorophenyl)methyl]carbazole is sourced from PubChem (CID 15206746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).