9-(3-piperazin-1-ylprop-2-enyl)carbazole

C19H21N3 — CID 173037585

IUPAC9-(3-piperazin-1-ylprop-2-enyl)carbazole
SMILESC(=CN1CCNCC1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C19H21N3/c1-3-8-18-16(6-1)17-7-2-4-9-19(17)22(18)13-5-12-21-14-10-20-11-15-21/h1-9,12,20H,10-11,13-15H2
InChIKeyPDKJDWMMVFMKHW-UHFFFAOYSA-N
MW291.40 g/mol
LogP3.21
Rot. Bonds3

About 9-(3-piperazin-1-ylprop-2-enyl)carbazole

9-(3-piperazin-1-ylprop-2-enyl)carbazole (PubChem CID 173037585) has the molecular formula C19H21N3 and a molecular weight of 291.40 g/mol. Its IUPAC name is 9-(3-piperazin-1-ylprop-2-enyl)carbazole.

Molecular Properties

Compound Name9-(3-piperazin-1-ylprop-2-enyl)carbazole
PubChem CID173037585
Molecular FormulaC19H21N3
Molecular Weight291.40 g/mol
Exact Mass291.17
IUPAC Name9-(3-piperazin-1-ylprop-2-enyl)carbazole
SMILESC(=CN1CCNCC1)Cn1c2ccccc2c2ccccc21
InChIInChI=1S/C19H21N3/c1-3-8-18-16(6-1)17-7-2-4-9-19(17)22(18)13-5-12-21-14-10-20-11-15-21/h1-9,12,20H,10-11,13-15H2
InChIKeyPDKJDWMMVFMKHW-UHFFFAOYSA-N
XLogP3.21
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-(3-piperazin-1-ylprop-2-enyl)carbazole?
The IUPAC name of 9-(3-piperazin-1-ylprop-2-enyl)carbazole (CID 173037585) is 9-(3-piperazin-1-ylprop-2-enyl)carbazole.
What is the SMILES notation for 9-(3-piperazin-1-ylprop-2-enyl)carbazole?
The canonical SMILES for 9-(3-piperazin-1-ylprop-2-enyl)carbazole is C(=CN1CCNCC1)Cn1c2ccccc2c2ccccc21.
What is the InChIKey of 9-(3-piperazin-1-ylprop-2-enyl)carbazole?
The InChIKey is PDKJDWMMVFMKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3/c1-3-8-18-16(6-1)17-7-2-4-9-19(17)22(18)13-5-12-21-14-10-20-11-15-21/h1-9,12,20H,10-11,13-15H2.
What are the key properties of 9-(3-piperazin-1-ylprop-2-enyl)carbazole?
9-(3-piperazin-1-ylprop-2-enyl)carbazole has a molecular weight of 291.40 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(3-piperazin-1-ylprop-2-enyl)carbazole is sourced from PubChem (CID 173037585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).