9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride

C19H24ClN3 — CID 156592203

IUPAC9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride
SMILESCCn1c2ccccc2c2cc(CN3CCNCC3)ccc21.Cl
InChIInChI=1S/C19H23N3.ClH/c1-2-22-18-6-4-3-5-16(18)17-13-15(7-8-19(17)22)14-21-11-9-20-10-12-21;/h3-8,13,20H,2,9-12,14H2,1H3;1H
InChIKeyDKTFXRHHINDXNO-UHFFFAOYSA-N
MW329.88 g/mol
LogP3.64
Rot. Bonds3

About 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride

9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride (PubChem CID 156592203) has the molecular formula C19H24ClN3 and a molecular weight of 329.88 g/mol. Its IUPAC name is 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride.

Molecular Properties

Compound Name9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride
PubChem CID156592203
Molecular FormulaC19H24ClN3
Molecular Weight329.88 g/mol
Exact Mass329.17
IUPAC Name9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride
SMILESCCn1c2ccccc2c2cc(CN3CCNCC3)ccc21.Cl
InChIInChI=1S/C19H23N3.ClH/c1-2-22-18-6-4-3-5-16(18)17-13-15(7-8-19(17)22)14-21-11-9-20-10-12-21;/h3-8,13,20H,2,9-12,14H2,1H3;1H
InChIKeyDKTFXRHHINDXNO-UHFFFAOYSA-N
XLogP3.64
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.88
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride?
The IUPAC name of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride (CID 156592203) is 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride.
What is the SMILES notation for 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride?
The canonical SMILES for 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride is CCn1c2ccccc2c2cc(CN3CCNCC3)ccc21.Cl.
What is the InChIKey of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride?
The InChIKey is DKTFXRHHINDXNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3.ClH/c1-2-22-18-6-4-3-5-16(18)17-13-15(7-8-19(17)22)14-21-11-9-20-10-12-21;/h3-8,13,20H,2,9-12,14H2,1H3;1H.
What are the key properties of 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride?
9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride has a molecular weight of 329.88 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride is sourced from PubChem (CID 156592203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).