9-(3-chloropropyl)carbazole

C15H14ClN — CID 14737436

IUPAC9-(3-chloropropyl)carbazole
SMILESClCCCn1c2ccccc2c2ccccc21
InChIInChI=1S/C15H14ClN/c16-10-5-11-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2
InChIKeyUGBPRCATQAWIJH-UHFFFAOYSA-N
MW243.74 g/mol
LogP4.42
Rot. Bonds3

About 9-(3-chloropropyl)carbazole

9-(3-chloropropyl)carbazole (PubChem CID 14737436) has the molecular formula C15H14ClN and a molecular weight of 243.74 g/mol. Its IUPAC name is 9-(3-chloropropyl)carbazole.

Molecular Properties

Compound Name9-(3-chloropropyl)carbazole
PubChem CID14737436
Molecular FormulaC15H14ClN
Molecular Weight243.74 g/mol
Exact Mass243.08
IUPAC Name9-(3-chloropropyl)carbazole
SMILESClCCCn1c2ccccc2c2ccccc21
InChIInChI=1S/C15H14ClN/c16-10-5-11-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2
InChIKeyUGBPRCATQAWIJH-UHFFFAOYSA-N
XLogP4.42
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-(3-chloropropyl)carbazole?
The IUPAC name of 9-(3-chloropropyl)carbazole (CID 14737436) is 9-(3-chloropropyl)carbazole.
What is the SMILES notation for 9-(3-chloropropyl)carbazole?
The canonical SMILES for 9-(3-chloropropyl)carbazole is ClCCCn1c2ccccc2c2ccccc21.
What is the InChIKey of 9-(3-chloropropyl)carbazole?
The InChIKey is UGBPRCATQAWIJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN/c16-10-5-11-17-14-8-3-1-6-12(14)13-7-2-4-9-15(13)17/h1-4,6-9H,5,10-11H2.
What are the key properties of 9-(3-chloropropyl)carbazole?
9-(3-chloropropyl)carbazole has a molecular weight of 243.74 g/mol, XLogP of 4.42, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-chloropropyl)carbazole is sourced from PubChem (CID 14737436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).