9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole

C20H25N3 — CID 171282163

IUPAC9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole
SMILESCCn1c2ccccc2c2cc([C@H](C)N3CCNCC3)ccc21
InChIInChI=1S/C20H25N3/c1-3-23-19-7-5-4-6-17(19)18-14-16(8-9-20(18)23)15(2)22-12-10-21-11-13-22/h4-9,14-15,21H,3,10-13H2,1-2H3/t15-/m0/s1
InChIKeyKKUBXRPYKYQHCD-HNNXBMFYSA-N
MW307.44 g/mol
LogP3.78
Rot. Bonds3

About 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole

9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole (PubChem CID 171282163) has the molecular formula C20H25N3 and a molecular weight of 307.44 g/mol. Its IUPAC name is 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole.

Molecular Properties

Compound Name9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole
PubChem CID171282163
Molecular FormulaC20H25N3
Molecular Weight307.44 g/mol
Exact Mass307.20
IUPAC Name9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole
SMILESCCn1c2ccccc2c2cc([C@H](C)N3CCNCC3)ccc21
InChIInChI=1S/C20H25N3/c1-3-23-19-7-5-4-6-17(19)18-14-16(8-9-20(18)23)15(2)22-12-10-21-11-13-22/h4-9,14-15,21H,3,10-13H2,1-2H3/t15-/m0/s1
InChIKeyKKUBXRPYKYQHCD-HNNXBMFYSA-N
XLogP3.78
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

9-ethyl-3-[(1R)-1-piperazin-1-ylbut-3-enyl]carbazole
CID 171294795
(3S)-3-(9-ethylcarbazol-3-yl)-3-piperazin-1-ylpropan-1-ol;hydrochloride
CID 171189705
3-[(S)-cyclobutyl(piperazin-1-yl)methyl]-9-ethylcarbazole;dihydrochloride
CID 171282180
9-ethyl-3-[(1R)-3-methyl-1-piperazin-1-ylbut-3-enyl]carbazole;dihydrochloride
CID 171294822
3-butan-2-yl-9-ethylcarbazole
CID 23520664
9-ethyl-3-(piperazin-1-ylmethyl)carbazole;hydrochloride
CID 156592203
9-ethyl-3-(piperazin-1-ylmethyl)carbazole;dihydrochloride
CID 75531489
1-[(1R)-1-naphthalen-2-ylethyl]piperazine
CID 93464443
(1R)-1-(9-ethylcarbazol-3-yl)-2-fluoroethanamine;hydrochloride
CID 171232651
(R)-cyclopropyl-(9-ethylcarbazol-3-yl)methanamine
CID 171213067
(1S)-1-(9-ethylcarbazol-3-yl)butane-1,4-diamine
CID 171232656
1-[(1S)-1-phenylethyl]piperazine;dihydrochloride
CID 57383523

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole?
The IUPAC name of 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole (CID 171282163) is 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole.
What is the SMILES notation for 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole?
The canonical SMILES for 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole is CCn1c2ccccc2c2cc([C@H](C)N3CCNCC3)ccc21.
What is the InChIKey of 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole?
The InChIKey is KKUBXRPYKYQHCD-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H25N3/c1-3-23-19-7-5-4-6-17(19)18-14-16(8-9-20(18)23)15(2)22-12-10-21-11-13-22/h4-9,14-15,21H,3,10-13H2,1-2H3/t15-/m0/s1.
What are the key properties of 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole?
9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole has a molecular weight of 307.44 g/mol, XLogP of 3.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-[(1S)-1-piperazin-1-ylethyl]carbazole is sourced from PubChem (CID 171282163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).