2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide

C16H23N3O5 — CID 132777070

IUPAC2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide
SMILESCNC(=O)CC1(COC)CN(C(=O)c2cccnc2OC)CCO1
InChIInChI=1S/C16H23N3O5/c1-17-13(20)9-16(11-22-2)10-19(7-8-24-16)15(21)12-5-4-6-18-14(12)23-3/h4-6H,7-11H2,1-3H3,(H,17,20)
InChIKeyQXGIJZRZLHNRDK-UHFFFAOYSA-N
MW337.38 g/mol
LogP0.08
Rot. Bonds6

About 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide

2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide (PubChem CID 132777070) has the molecular formula C16H23N3O5 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide
PubChem CID132777070
Molecular FormulaC16H23N3O5
Molecular Weight337.38 g/mol
Exact Mass337.16
IUPAC Name2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide
SMILESCNC(=O)CC1(COC)CN(C(=O)c2cccnc2OC)CCO1
InChIInChI=1S/C16H23N3O5/c1-17-13(20)9-16(11-22-2)10-19(7-8-24-16)15(21)12-5-4-6-18-14(12)23-3/h4-6H,7-11H2,1-3H3,(H,17,20)
InChIKeyQXGIJZRZLHNRDK-UHFFFAOYSA-N
XLogP0.08
TPSA89.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide?
The IUPAC name of 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide (CID 132777070) is 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide.
What is the SMILES notation for 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide?
The canonical SMILES for 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide is CNC(=O)CC1(COC)CN(C(=O)c2cccnc2OC)CCO1.
What is the InChIKey of 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide?
The InChIKey is QXGIJZRZLHNRDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O5/c1-17-13(20)9-16(11-22-2)10-19(7-8-24-16)15(21)12-5-4-6-18-14(12)23-3/h4-6H,7-11H2,1-3H3,(H,17,20).
What are the key properties of 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide?
2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide has a molecular weight of 337.38 g/mol, XLogP of 0.08, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methoxymethyl)-4-(2-methoxypyridine-3-carbonyl)morpholin-2-yl]-N-methylacetamide is sourced from PubChem (CID 132777070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).