4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline

C17H14N6 — CID 20917193

IUPAC4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline
SMILESCc1ccc2nc(N3CCc4ccccc43)c3nnnn3c2c1
InChIInChI=1S/C17H14N6/c1-11-6-7-13-15(10-11)23-17(19-20-21-23)16(18-13)22-9-8-12-4-2-3-5-14(12)22/h2-7,10H,8-9H2,1H3
InChIKeyRMMHLJHZEISYCD-UHFFFAOYSA-N
MW302.34 g/mol
LogP2.68
Rot. Bonds1

About 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline

4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline (PubChem CID 20917193) has the molecular formula C17H14N6 and a molecular weight of 302.34 g/mol. Its IUPAC name is 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline.

Molecular Properties

Compound Name4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline
PubChem CID20917193
Molecular FormulaC17H14N6
Molecular Weight302.34 g/mol
Exact Mass302.13
IUPAC Name4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline
SMILESCc1ccc2nc(N3CCc4ccccc43)c3nnnn3c2c1
InChIInChI=1S/C17H14N6/c1-11-6-7-13-15(10-11)23-17(19-20-21-23)16(18-13)22-9-8-12-4-2-3-5-14(12)22/h2-7,10H,8-9H2,1H3
InChIKeyRMMHLJHZEISYCD-UHFFFAOYSA-N
XLogP2.68
TPSA59.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline?
The IUPAC name of 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline (CID 20917193) is 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline.
What is the SMILES notation for 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline?
The canonical SMILES for 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline is Cc1ccc2nc(N3CCc4ccccc43)c3nnnn3c2c1.
What is the InChIKey of 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline?
The InChIKey is RMMHLJHZEISYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N6/c1-11-6-7-13-15(10-11)23-17(19-20-21-23)16(18-13)22-9-8-12-4-2-3-5-14(12)22/h2-7,10H,8-9H2,1H3.
What are the key properties of 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline?
4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline has a molecular weight of 302.34 g/mol, XLogP of 2.68, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dihydroindol-1-yl)-8-methyltetrazolo[1,5-a]quinoxaline is sourced from PubChem (CID 20917193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).