2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine

C17H19N3O — CID 19978068

IUPAC2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine
SMILESCC1CN(c2nc3ccccc3n3cccc23)CC(C)O1
InChIInChI=1S/C17H19N3O/c1-12-10-19(11-13(2)21-12)17-16-8-5-9-20(16)15-7-4-3-6-14(15)18-17/h3-9,12-13H,10-11H2,1-2H3
InChIKeyLSABEHLLNHIICI-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.10
Rot. Bonds1

About 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine

2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine (PubChem CID 19978068) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine
PubChem CID19978068
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine
SMILESCC1CN(c2nc3ccccc3n3cccc23)CC(C)O1
InChIInChI=1S/C17H19N3O/c1-12-10-19(11-13(2)21-12)17-16-8-5-9-20(16)15-7-4-3-6-14(15)18-17/h3-9,12-13H,10-11H2,1-2H3
InChIKeyLSABEHLLNHIICI-UHFFFAOYSA-N
XLogP3.10
TPSA29.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]quinoxalin-2-amine
CID 102987519
2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]imidazo[1,2-a]pyridine-3-carbonitrile
CID 133463527
N-cyclopropyl-1-pyrrolo[1,2-a]quinoxalin-4-ylpiperidine-4-carboxamide
CID 22522818
N-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]benzenesulfonamide
CID 4106272
2-phenylsulfanyl-1-(4-pyrrolo[1,2-a]quinoxalin-4-ylpiperazin-1-yl)ethanone
CID 46259510
3-[2-(2,6-dimethylmorpholin-4-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
CID 3778670
N-cyclopentyl-1-pyrrolo[1,2-a]quinoxalin-4-ylpiperidine-3-carboxamide
CID 22522891
3-(2,6-dimethylmorpholin-4-yl)-N-[2-(triazol-1-yl)ethyl]quinoxalin-2-amine
CID 133449275
N-propan-2-yl-4-pyrrolo[1,2-a]quinoxalin-4-yl-1,4-diazepane-1-carboxamide
CID 50805235
2,6-dimethyl-4-[3-[4-(oxolan-2-yl)piperidin-1-yl]quinoxalin-2-yl]morpholine
CID 127996191
4-[2-(2-chlorophenyl)quinazolin-4-yl]-2,6-dimethylmorpholine
CID 23828257
N-(2-methoxyethyl)-1-pyrrolo[1,2-a]quinoxalin-4-ylpiperidine-4-carboxamide
CID 126458585

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine?
The IUPAC name of 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine (CID 19978068) is 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine.
What is the SMILES notation for 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine?
The canonical SMILES for 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine is CC1CN(c2nc3ccccc3n3cccc23)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine?
The InChIKey is LSABEHLLNHIICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-12-10-19(11-13(2)21-12)17-16-8-5-9-20(16)15-7-4-3-6-14(15)18-17/h3-9,12-13H,10-11H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine?
2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine has a molecular weight of 281.36 g/mol, XLogP of 3.10, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-pyrrolo[1,2-a]quinoxalin-4-ylmorpholine is sourced from PubChem (CID 19978068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).