9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline

C22H24N4 — CID 151662365

IUPAC9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline
SMILESCc1ccc2c(c1)c1nc3ccccc3nc1n2CCCN1CCCC1
InChIInChI=1S/C22H24N4/c1-16-9-10-20-17(15-16)21-22(24-19-8-3-2-7-18(19)23-21)26(20)14-6-13-25-11-4-5-12-25/h2-3,7-10,15H,4-6,11-14H2,1H3
InChIKeyQWUNQNHHJYCWRT-UHFFFAOYSA-N
MW344.46 g/mol
LogP4.53
Rot. Bonds4

About 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline

9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline (PubChem CID 151662365) has the molecular formula C22H24N4 and a molecular weight of 344.46 g/mol. Its IUPAC name is 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline.

Molecular Properties

Compound Name9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline
PubChem CID151662365
Molecular FormulaC22H24N4
Molecular Weight344.46 g/mol
Exact Mass344.20
IUPAC Name9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline
SMILESCc1ccc2c(c1)c1nc3ccccc3nc1n2CCCN1CCCC1
InChIInChI=1S/C22H24N4/c1-16-9-10-20-17(15-16)21-22(24-19-8-3-2-7-18(19)23-21)26(20)14-6-13-25-11-4-5-12-25/h2-3,7-10,15H,4-6,11-14H2,1H3
InChIKeyQWUNQNHHJYCWRT-UHFFFAOYSA-N
XLogP4.53
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline?
The IUPAC name of 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline (CID 151662365) is 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline.
What is the SMILES notation for 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline?
The canonical SMILES for 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline is Cc1ccc2c(c1)c1nc3ccccc3nc1n2CCCN1CCCC1.
What is the InChIKey of 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline?
The InChIKey is QWUNQNHHJYCWRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4/c1-16-9-10-20-17(15-16)21-22(24-19-8-3-2-7-18(19)23-21)26(20)14-6-13-25-11-4-5-12-25/h2-3,7-10,15H,4-6,11-14H2,1H3.
What are the key properties of 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline?
9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline has a molecular weight of 344.46 g/mol, XLogP of 4.53, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-6-(3-pyrrolidin-1-ylpropyl)indolo[3,2-b]quinoxaline is sourced from PubChem (CID 151662365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).