6-[1-(1H-indol-5-yl)propyl]quinoxaline

C19H17N3 — CID 174566822

IUPAC6-[1-(1H-indol-5-yl)propyl]quinoxaline
SMILESCCC(c1ccc2[nH]ccc2c1)c1ccc2nccnc2c1
InChIInChI=1S/C19H17N3/c1-2-16(13-3-5-17-15(11-13)7-8-20-17)14-4-6-18-19(12-14)22-10-9-21-18/h3-12,16,20H,2H2,1H3
InChIKeyZFJQMYZMZCMWRX-UHFFFAOYSA-N
MW287.37 g/mol
LogP4.65
Rot. Bonds3

About 6-[1-(1H-indol-5-yl)propyl]quinoxaline

6-[1-(1H-indol-5-yl)propyl]quinoxaline (PubChem CID 174566822) has the molecular formula C19H17N3 and a molecular weight of 287.37 g/mol. Its IUPAC name is 6-[1-(1H-indol-5-yl)propyl]quinoxaline.

Molecular Properties

Compound Name6-[1-(1H-indol-5-yl)propyl]quinoxaline
PubChem CID174566822
Molecular FormulaC19H17N3
Molecular Weight287.37 g/mol
Exact Mass287.14
IUPAC Name6-[1-(1H-indol-5-yl)propyl]quinoxaline
SMILESCCC(c1ccc2[nH]ccc2c1)c1ccc2nccnc2c1
InChIInChI=1S/C19H17N3/c1-2-16(13-3-5-17-15(11-13)7-8-20-17)14-4-6-18-19(12-14)22-10-9-21-18/h3-12,16,20H,2H2,1H3
InChIKeyZFJQMYZMZCMWRX-UHFFFAOYSA-N
XLogP4.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1H-indol-5-yl)-N-methyl-3-quinoxalin-6-ylpropan-1-amine
CID 59831857
5-butan-2-yl-1H-indole;molecular hydrogen
CID 144711250
5-propan-2-yl-1H-indole
CID 10558918
N-(1H-indol-5-ylmethyl)quinoxalin-6-amine
CID 102910076
5-(1-chloroethyl)-1H-indole
CID 174700849
1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol
CID 114557062
3-(1H-indol-5-yl)-3-(1H-indol-6-yl)-N-methylpropan-1-amine
CID 59831603
1-(1H-indol-5-yl)heptan-1-ol
CID 81444731
hexanedioic acid;bis(1-(1H-indol-5-yl)ethanamine)
CID 15140319
(1R)-1-(1H-indol-5-yl)-N-methylethanamine
CID 55276552
5-[2-ethyl-1-(1,2,4-triazol-1-yl)butyl]-1H-indole
CID 154686601
(2R)-2-amino-2-(1H-indol-5-yl)acetonitrile
CID 131106135

Frequently Asked Questions

What is the IUPAC name of 6-[1-(1H-indol-5-yl)propyl]quinoxaline?
The IUPAC name of 6-[1-(1H-indol-5-yl)propyl]quinoxaline (CID 174566822) is 6-[1-(1H-indol-5-yl)propyl]quinoxaline.
What is the SMILES notation for 6-[1-(1H-indol-5-yl)propyl]quinoxaline?
The canonical SMILES for 6-[1-(1H-indol-5-yl)propyl]quinoxaline is CCC(c1ccc2[nH]ccc2c1)c1ccc2nccnc2c1.
What is the InChIKey of 6-[1-(1H-indol-5-yl)propyl]quinoxaline?
The InChIKey is ZFJQMYZMZCMWRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3/c1-2-16(13-3-5-17-15(11-13)7-8-20-17)14-4-6-18-19(12-14)22-10-9-21-18/h3-12,16,20H,2H2,1H3.
What are the key properties of 6-[1-(1H-indol-5-yl)propyl]quinoxaline?
6-[1-(1H-indol-5-yl)propyl]quinoxaline has a molecular weight of 287.37 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(1H-indol-5-yl)propyl]quinoxaline is sourced from PubChem (CID 174566822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).