1-nonyl-9H-carbazole

C21H27N — CID 66872642

IUPAC1-nonyl-9H-carbazole
SMILESCCCCCCCCCc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C21H27N/c1-2-3-4-5-6-7-8-12-17-13-11-15-19-18-14-9-10-16-20(18)22-21(17)19/h9-11,13-16,22H,2-8,12H2,1H3
InChIKeyGBEIZYKXXVPFOB-UHFFFAOYSA-N
MW293.45 g/mol
LogP6.61
Rot. Bonds8

About 1-nonyl-9H-carbazole

1-nonyl-9H-carbazole (PubChem CID 66872642) has the molecular formula C21H27N and a molecular weight of 293.45 g/mol. Its IUPAC name is 1-nonyl-9H-carbazole.

Molecular Properties

Compound Name1-nonyl-9H-carbazole
PubChem CID66872642
Molecular FormulaC21H27N
Molecular Weight293.45 g/mol
Exact Mass293.21
IUPAC Name1-nonyl-9H-carbazole
SMILESCCCCCCCCCc1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C21H27N/c1-2-3-4-5-6-7-8-12-17-13-11-15-19-18-14-9-10-16-20(18)22-21(17)19/h9-11,13-16,22H,2-8,12H2,1H3
InChIKeyGBEIZYKXXVPFOB-UHFFFAOYSA-N
XLogP6.61
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.45
LogP ≤ 56.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-butyl-9H-carbazole;phosphane;hydrate
CID 174715058
2-[2-(9H-carbazol-1-yl)ethyl]undecan-1-ol
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CID 142709978
1-(6-phenoxyhexyl)-9H-carbazole
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1-butyl-11H-benzo[a]carbazole
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9H-carbazol-1-ylmethanol
CID 10987211
1-tetradecylnaphthalene
CID 14402128
1-but-3-ynyl-9H-carbazole
CID 173036439
1,2-di(undecyl)benzene
CID 3019479
1-dodecyl-2-hexylbenzene
CID 19371073
1-nonyl-2-pentylbenzene
CID 54050070
1-hexadecyl-2-pentylbenzene
CID 53438584

Frequently Asked Questions

What is the IUPAC name of 1-nonyl-9H-carbazole?
The IUPAC name of 1-nonyl-9H-carbazole (CID 66872642) is 1-nonyl-9H-carbazole.
What is the SMILES notation for 1-nonyl-9H-carbazole?
The canonical SMILES for 1-nonyl-9H-carbazole is CCCCCCCCCc1cccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-nonyl-9H-carbazole?
The InChIKey is GBEIZYKXXVPFOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N/c1-2-3-4-5-6-7-8-12-17-13-11-15-19-18-14-9-10-16-20(18)22-21(17)19/h9-11,13-16,22H,2-8,12H2,1H3.
What are the key properties of 1-nonyl-9H-carbazole?
1-nonyl-9H-carbazole has a molecular weight of 293.45 g/mol, XLogP of 6.61, 8 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nonyl-9H-carbazole is sourced from PubChem (CID 66872642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).