4-propyl-9H-carbazole-3-carbaldehyde

C16H15NO — CID 143973310

IUPAC4-propyl-9H-carbazole-3-carbaldehyde
SMILESCCCc1c(C=O)ccc2[nH]c3ccccc3c12
InChIInChI=1S/C16H15NO/c1-2-5-12-11(10-18)8-9-15-16(12)13-6-3-4-7-14(13)17-15/h3-4,6-10,17H,2,5H2,1H3
InChIKeyUOYTWLKHAYCMRT-UHFFFAOYSA-N
MW237.30 g/mol
LogP4.09
Rot. Bonds3

About 4-propyl-9H-carbazole-3-carbaldehyde

4-propyl-9H-carbazole-3-carbaldehyde (PubChem CID 143973310) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 4-propyl-9H-carbazole-3-carbaldehyde.

Molecular Properties

Compound Name4-propyl-9H-carbazole-3-carbaldehyde
PubChem CID143973310
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name4-propyl-9H-carbazole-3-carbaldehyde
SMILESCCCc1c(C=O)ccc2[nH]c3ccccc3c12
InChIInChI=1S/C16H15NO/c1-2-5-12-11(10-18)8-9-15-16(12)13-6-3-4-7-14(13)17-15/h3-4,6-10,17H,2,5H2,1H3
InChIKeyUOYTWLKHAYCMRT-UHFFFAOYSA-N
XLogP4.09
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-phenyl-3-propyl-9H-carbazole
CID 21444099
2-methyl-3-propyl-1H-quinolin-4-one
CID 826058
3-ethyl-9H-carbazol-4-ol
CID 163569607
3-butyl-4-oxo-1H-quinoline-2-carbaldehyde
CID 174731856
2-chloro-9H-carbazole-4-carbaldehyde
CID 150983471
bis(9H-carbazole);propane
CID 90987002
3-ethyl-2-propyl-1H-indole
CID 65335384
1-propyl-9H-carbazole-3-carbaldehyde
CID 174900118
2-but-3-en-2-yl-3-propyl-1H-indole
CID 143390635
(E)-4-(3,6-dihydropyrrolo[2,3-c]carbazol-1-yl)but-3-en-2-one
CID 12648620
3-(2-methoxyethyl)-1H-indole-2-carbaldehyde
CID 121011064
9H-carbazole-1-carbaldehyde
CID 11745551

Frequently Asked Questions

What is the IUPAC name of 4-propyl-9H-carbazole-3-carbaldehyde?
The IUPAC name of 4-propyl-9H-carbazole-3-carbaldehyde (CID 143973310) is 4-propyl-9H-carbazole-3-carbaldehyde.
What is the SMILES notation for 4-propyl-9H-carbazole-3-carbaldehyde?
The canonical SMILES for 4-propyl-9H-carbazole-3-carbaldehyde is CCCc1c(C=O)ccc2[nH]c3ccccc3c12.
What is the InChIKey of 4-propyl-9H-carbazole-3-carbaldehyde?
The InChIKey is UOYTWLKHAYCMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c1-2-5-12-11(10-18)8-9-15-16(12)13-6-3-4-7-14(13)17-15/h3-4,6-10,17H,2,5H2,1H3.
What are the key properties of 4-propyl-9H-carbazole-3-carbaldehyde?
4-propyl-9H-carbazole-3-carbaldehyde has a molecular weight of 237.30 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propyl-9H-carbazole-3-carbaldehyde is sourced from PubChem (CID 143973310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).