ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione

C20H23N3O2 — CID 170584325

IUPACethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione
SMILESCC.CCc1cccc2c1c1cccnc1n2C1CCC(=O)NC1=O
InChIInChI=1S/C18H17N3O2.C2H6/c1-2-11-5-3-7-13-16(11)12-6-4-10-19-17(12)21(13)14-8-9-15(22)20-18(14)23;1-2/h3-7,10,14H,2,8-9H2,1H3,(H,20,22,23);1-2H3
InChIKeyCDNINOUCVMLNPA-UHFFFAOYSA-N
MW337.42 g/mol
LogP3.76
Rot. Bonds2

About ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione

ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione (PubChem CID 170584325) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione.

Molecular Properties

Compound Nameethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione
PubChem CID170584325
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Nameethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione
SMILESCC.CCc1cccc2c1c1cccnc1n2C1CCC(=O)NC1=O
InChIInChI=1S/C18H17N3O2.C2H6/c1-2-11-5-3-7-13-16(11)12-6-4-10-19-17(12)21(13)14-8-9-15(22)20-18(14)23;1-2/h3-7,10,14H,2,8-9H2,1H3,(H,20,22,23);1-2H3
InChIKeyCDNINOUCVMLNPA-UHFFFAOYSA-N
XLogP3.76
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethane;3-(5-methylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione
CID 156795243
3-(5-methylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione
CID 142616477
5-[9-(2,6-dioxopiperidin-3-yl)pyrido[2,3-b]indol-5-yl]pentanal
CID 151240446
3-[5-[3-[2-(2-aminoethoxy)ethoxy]propyl]pyrido[2,3-b]indol-9-yl]piperidine-2,6-dione
CID 138695172
3-pyrido[2,3-b]indol-9-ylpiperidine-2,6-dione
CID 138728131
3-(4-ethyl-1,3-dimethylideneisoindol-2-yl)piperidine-2,6-dione
CID 144735375
3-(4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-8-yl)piperidine-2,6-dione
CID 153310470
3-[5-[3-[2-(2-phenylmethoxyethoxy)ethoxy]prop-1-ynyl]pyrido[2,3-b]indol-9-yl]piperidine-2,6-dione;3-[5-[3-(2-propoxyethoxy)propyl]pyrido[2,3-b]indol-9-yl]piperidine-2,6-dione
CID 167674228
3-[2-[9-(2,6-dioxopiperidin-3-yl)pyrido[2,3-b]indol-7-yl]carbazol-9-yl]piperidine-2,6-dione
CID 153390253
3-(4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraen-8-yl)piperidine-2,6-dione
CID 153310477
3-(4-but-1-ynylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione
CID 167693243
9-(2,6-dioxopiperidin-3-yl)pyrido[2,3-b]indole-4-carbaldehyde
CID 146598559

Frequently Asked Questions

What is the IUPAC name of ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione?
The IUPAC name of ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione (CID 170584325) is ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione.
What is the SMILES notation for ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione?
The canonical SMILES for ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione is CC.CCc1cccc2c1c1cccnc1n2C1CCC(=O)NC1=O.
What is the InChIKey of ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione?
The InChIKey is CDNINOUCVMLNPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2.C2H6/c1-2-11-5-3-7-13-16(11)12-6-4-10-19-17(12)21(13)14-8-9-15(22)20-18(14)23;1-2/h3-7,10,14H,2,8-9H2,1H3,(H,20,22,23);1-2H3.
What are the key properties of ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione?
ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione has a molecular weight of 337.42 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(5-ethylpyrido[2,3-b]indol-9-yl)piperidine-2,6-dione is sourced from PubChem (CID 170584325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).