1-(4-prop-1-enylphenyl)-9H-carbazole

C21H17N — CID 175584569

IUPAC1-(4-prop-1-enylphenyl)-9H-carbazole
SMILESCC=Cc1ccc(-c2cccc3c2[nH]c2ccccc23)cc1
InChIInChI=1S/C21H17N/c1-2-6-15-11-13-16(14-12-15)17-8-5-9-19-18-7-3-4-10-20(18)22-21(17)19/h2-14,22H,1H3
InChIKeyICFVYLSEQMACDB-UHFFFAOYSA-N
MW283.37 g/mol
LogP6.02
Rot. Bonds2

About 1-(4-prop-1-enylphenyl)-9H-carbazole

1-(4-prop-1-enylphenyl)-9H-carbazole (PubChem CID 175584569) has the molecular formula C21H17N and a molecular weight of 283.37 g/mol. Its IUPAC name is 1-(4-prop-1-enylphenyl)-9H-carbazole.

Molecular Properties

Compound Name1-(4-prop-1-enylphenyl)-9H-carbazole
PubChem CID175584569
Molecular FormulaC21H17N
Molecular Weight283.37 g/mol
Exact Mass283.14
IUPAC Name1-(4-prop-1-enylphenyl)-9H-carbazole
SMILESCC=Cc1ccc(-c2cccc3c2[nH]c2ccccc23)cc1
InChIInChI=1S/C21H17N/c1-2-6-15-11-13-16(14-12-15)17-8-5-9-19-18-7-3-4-10-20(18)22-21(17)19/h2-14,22H,1H3
InChIKeyICFVYLSEQMACDB-UHFFFAOYSA-N
XLogP6.02
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.37
LogP ≤ 56.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(4-prop-1-enylphenyl)-9H-carbazole?
The IUPAC name of 1-(4-prop-1-enylphenyl)-9H-carbazole (CID 175584569) is 1-(4-prop-1-enylphenyl)-9H-carbazole.
What is the SMILES notation for 1-(4-prop-1-enylphenyl)-9H-carbazole?
The canonical SMILES for 1-(4-prop-1-enylphenyl)-9H-carbazole is CC=Cc1ccc(-c2cccc3c2[nH]c2ccccc23)cc1.
What is the InChIKey of 1-(4-prop-1-enylphenyl)-9H-carbazole?
The InChIKey is ICFVYLSEQMACDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N/c1-2-6-15-11-13-16(14-12-15)17-8-5-9-19-18-7-3-4-10-20(18)22-21(17)19/h2-14,22H,1H3.
What are the key properties of 1-(4-prop-1-enylphenyl)-9H-carbazole?
1-(4-prop-1-enylphenyl)-9H-carbazole has a molecular weight of 283.37 g/mol, XLogP of 6.02, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-prop-1-enylphenyl)-9H-carbazole is sourced from PubChem (CID 175584569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).