3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine

C19H23N5O2 — CID 71846707

IUPAC3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine
SMILESCc1cc(CNc2nc3ccccc3nc2N2CC(C)OC(C)C2)no1
InChIInChI=1S/C19H23N5O2/c1-12-8-15(23-26-12)9-20-18-19(24-10-13(2)25-14(3)11-24)22-17-7-5-4-6-16(17)21-18/h4-8,13-14H,9-11H2,1-3H3,(H,20,21)
InChIKeyHSEMHBGXGIIMAY-UHFFFAOYSA-N
MW353.43 g/mol
LogP3.15
Rot. Bonds4

About 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine

3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine (PubChem CID 71846707) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine.

Molecular Properties

Compound Name3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine
PubChem CID71846707
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine
SMILESCc1cc(CNc2nc3ccccc3nc2N2CC(C)OC(C)C2)no1
InChIInChI=1S/C19H23N5O2/c1-12-8-15(23-26-12)9-20-18-19(24-10-13(2)25-14(3)11-24)22-17-7-5-4-6-16(17)21-18/h4-8,13-14H,9-11H2,1-3H3,(H,20,21)
InChIKeyHSEMHBGXGIIMAY-UHFFFAOYSA-N
XLogP3.15
TPSA76.31 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine?
The IUPAC name of 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine (CID 71846707) is 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine.
What is the SMILES notation for 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine?
The canonical SMILES for 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine is Cc1cc(CNc2nc3ccccc3nc2N2CC(C)OC(C)C2)no1.
What is the InChIKey of 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine?
The InChIKey is HSEMHBGXGIIMAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-12-8-15(23-26-12)9-20-18-19(24-10-13(2)25-14(3)11-24)22-17-7-5-4-6-16(17)21-18/h4-8,13-14H,9-11H2,1-3H3,(H,20,21).
What are the key properties of 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine?
3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine has a molecular weight of 353.43 g/mol, XLogP of 3.15, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dimethylmorpholin-4-yl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinoxalin-2-amine is sourced from PubChem (CID 71846707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).