[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone

C19H23N3O3 — CID 124952972

IUPAC[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
SMILESCNc1cccc([C@H]2CN(C(=O)c3cccc(COC)c3)CCO2)n1
InChIInChI=1S/C19H23N3O3/c1-20-18-8-4-7-16(21-18)17-12-22(9-10-25-17)19(23)15-6-3-5-14(11-15)13-24-2/h3-8,11,17H,9-10,12-13H2,1-2H3,(H,20,21)/t17-/m1/s1
InChIKeyDSKFPZMLWZQXOR-QGZVFWFLSA-N
MW341.41 g/mol
LogP2.48
Rot. Bonds5

About [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone

[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone (PubChem CID 124952972) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone.

Molecular Properties

Compound Name[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
PubChem CID124952972
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
SMILESCNc1cccc([C@H]2CN(C(=O)c3cccc(COC)c3)CCO2)n1
InChIInChI=1S/C19H23N3O3/c1-20-18-8-4-7-16(21-18)17-12-22(9-10-25-17)19(23)15-6-3-5-14(11-15)13-24-2/h3-8,11,17H,9-10,12-13H2,1-2H3,(H,20,21)/t17-/m1/s1
InChIKeyDSKFPZMLWZQXOR-QGZVFWFLSA-N
XLogP2.48
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(methoxymethyl)phenyl]-[(2S)-2-(2-methylpyrimidin-4-yl)morpholin-4-yl]methanone
CID 125009284
[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-pyrimidin-5-ylmethanone
CID 124944788
[2-(3-chlorophenyl)morpholin-4-yl]-[3-(methoxymethyl)phenyl]methanone
CID 122138903
[(2S)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(1,3-oxazol-5-yl)methanone
CID 125003170
(5-tert-butyl-1H-pyrazol-3-yl)-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 124992900
[2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-(1-methylpyrrol-2-yl)methanone
CID 110112464
5-[6-[(2R)-4-[4-(methoxymethyl)benzoyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
CID 124973780
[(2S)-2-[6-[(4-ethoxyphenyl)methyl]-2-pyridinyl]morpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 125020350
1-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]-2-thiophen-2-ylethanone
CID 124986100
1H-imidazol-5-yl-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone
CID 125016046
[3-(methoxymethyl)phenyl]-[(2S)-2-(2-pyrimidin-4-ylethyl)morpholin-4-yl]methanone
CID 124997143
[3-(methoxymethyl)phenyl]-[2-(2-pyrimidin-4-ylethyl)morpholin-4-yl]methanone
CID 110119032

Frequently Asked Questions

What is the IUPAC name of [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone?
The IUPAC name of [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone (CID 124952972) is [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone.
What is the SMILES notation for [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone?
The canonical SMILES for [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone is CNc1cccc([C@H]2CN(C(=O)c3cccc(COC)c3)CCO2)n1.
What is the InChIKey of [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone?
The InChIKey is DSKFPZMLWZQXOR-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-20-18-8-4-7-16(21-18)17-12-22(9-10-25-17)19(23)15-6-3-5-14(11-15)13-24-2/h3-8,11,17H,9-10,12-13H2,1-2H3,(H,20,21)/t17-/m1/s1.
What are the key properties of [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone?
[3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone has a molecular weight of 341.41 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(methoxymethyl)phenyl]-[(2R)-2-[6-(methylamino)-2-pyridinyl]morpholin-4-yl]methanone is sourced from PubChem (CID 124952972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).