6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine

C18H25N3O2 — CID 128978215

IUPAC6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine
SMILESCOCC1CN(Cc2nc3ccccc3nc2C)CC(C)(C)O1
InChIInChI=1S/C18H25N3O2/c1-13-17(20-16-8-6-5-7-15(16)19-13)10-21-9-14(11-22-4)23-18(2,3)12-21/h5-8,14H,9-12H2,1-4H3
InChIKeyKLCAHONCNIJQKY-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.56
Rot. Bonds4

About 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine

6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine (PubChem CID 128978215) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine.

Molecular Properties

Compound Name6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine
PubChem CID128978215
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine
SMILESCOCC1CN(Cc2nc3ccccc3nc2C)CC(C)(C)O1
InChIInChI=1S/C18H25N3O2/c1-13-17(20-16-8-6-5-7-15(16)19-13)10-21-9-14(11-22-4)23-18(2,3)12-21/h5-8,14H,9-12H2,1-4H3
InChIKeyKLCAHONCNIJQKY-UHFFFAOYSA-N
XLogP2.56
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine?
The IUPAC name of 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine (CID 128978215) is 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine.
What is the SMILES notation for 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine?
The canonical SMILES for 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine is COCC1CN(Cc2nc3ccccc3nc2C)CC(C)(C)O1.
What is the InChIKey of 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine?
The InChIKey is KLCAHONCNIJQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c1-13-17(20-16-8-6-5-7-15(16)19-13)10-21-9-14(11-22-4)23-18(2,3)12-21/h5-8,14H,9-12H2,1-4H3.
What are the key properties of 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine?
6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine has a molecular weight of 315.42 g/mol, XLogP of 2.56, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine is sourced from PubChem (CID 128978215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).