[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone

C18H20N2O3 — CID 124999842

IUPAC[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone
SMILESCOc1cccc(C[C@@H]2CN(C(=O)c3ccncc3)CCO2)c1
InChIInChI=1S/C18H20N2O3/c1-22-16-4-2-3-14(11-16)12-17-13-20(9-10-23-17)18(21)15-5-7-19-8-6-15/h2-8,11,17H,9-10,12-13H2,1H3/t17-/m1/s1
InChIKeyRRQIMZPKGAWJBH-QGZVFWFLSA-N
MW312.37 g/mol
LogP2.17
Rot. Bonds4

About [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone

[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone (PubChem CID 124999842) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone.

Molecular Properties

Compound Name[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone
PubChem CID124999842
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone
SMILESCOc1cccc(C[C@@H]2CN(C(=O)c3ccncc3)CCO2)c1
InChIInChI=1S/C18H20N2O3/c1-22-16-4-2-3-14(11-16)12-17-13-20(9-10-23-17)18(21)15-5-7-19-8-6-15/h2-8,11,17H,9-10,12-13H2,1H3/t17-/m1/s1
InChIKeyRRQIMZPKGAWJBH-QGZVFWFLSA-N
XLogP2.17
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4-fluorophenyl)-[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methanone
CID 124942356
(3,4-dimethylphenyl)-[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methanone
CID 42344181
[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-[2-(methylamino)-4-pyridinyl]methanone
CID 45251144
[(2S)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-(2-methylpyrazol-3-yl)methanone
CID 25457567
1-[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-2-methylsulfanylethanone
CID 45248287
[2-(dimethylamino)phenyl]-[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methanone
CID 25283547
(3-chlorothiophen-2-yl)-[(2S)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]methanone
CID 26322636
3,3,3-trifluoro-1-[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]propan-1-one
CID 42189451
2-[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]acetic acid
CID 102604207
2-[(3-methoxyphenyl)methyl]-N-thiophen-2-ylmorpholine-4-carboxamide
CID 45204776
1-[2-[(3-methoxyphenyl)methyl]morpholine-4-carbonyl]cyclopropane-1-carboxamide
CID 45197469
2-(2-hydroxyphenoxy)-1-[2-[(3-methoxyphenyl)methyl]morpholin-4-yl]ethanone
CID 56864991

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone?
The IUPAC name of [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone (CID 124999842) is [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone.
What is the SMILES notation for [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone?
The canonical SMILES for [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone is COc1cccc(C[C@@H]2CN(C(=O)c3ccncc3)CCO2)c1.
What is the InChIKey of [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone?
The InChIKey is RRQIMZPKGAWJBH-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-22-16-4-2-3-14(11-16)12-17-13-20(9-10-23-17)18(21)15-5-7-19-8-6-15/h2-8,11,17H,9-10,12-13H2,1H3/t17-/m1/s1.
What are the key properties of [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone?
[(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone has a molecular weight of 312.37 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-[(3-methoxyphenyl)methyl]morpholin-4-yl]-pyridin-4-ylmethanone is sourced from PubChem (CID 124999842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).