(2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine

C17H21N3O2 — CID 124990787

IUPAC(2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine
SMILESCOc1ccc(C[C@@H]2CN(c3ccnc(C)n3)CCO2)cc1
InChIInChI=1S/C17H21N3O2/c1-13-18-8-7-17(19-13)20-9-10-22-16(12-20)11-14-3-5-15(21-2)6-4-14/h3-8,16H,9-12H2,1-2H3/t16-/m1/s1
InChIKeyPEIBNFUBPNZZSG-MRXNPFEDSA-N
MW299.37 g/mol
LogP2.24
Rot. Bonds4

About (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine

(2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine (PubChem CID 124990787) has the molecular formula C17H21N3O2 and a molecular weight of 299.37 g/mol. Its IUPAC name is (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name(2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine
PubChem CID124990787
Molecular FormulaC17H21N3O2
Molecular Weight299.37 g/mol
Exact Mass299.16
IUPAC Name(2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine
SMILESCOc1ccc(C[C@@H]2CN(c3ccnc(C)n3)CCO2)cc1
InChIInChI=1S/C17H21N3O2/c1-13-18-8-7-17(19-13)20-9-10-22-16(12-20)11-14-3-5-15(21-2)6-4-14/h3-8,16H,9-12H2,1-2H3/t16-/m1/s1
InChIKeyPEIBNFUBPNZZSG-MRXNPFEDSA-N
XLogP2.24
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-fluorophenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine
CID 102604304
4-benzyl-2-[(4-methoxyphenyl)methyl]morpholine
CID 142864926
[4-(5-methoxy-2-pyridinyl)morpholin-2-yl]methanol
CID 106504669
2-(5-methyl-1H-imidazol-2-yl)-4-(2-methylpyrimidin-4-yl)morpholine
CID 132775431
4-(2,6-dimethoxypyrimidin-4-yl)-2-[(3-methoxyphenyl)methyl]morpholine
CID 45197477
[(2S)-2-[(4-methoxyphenyl)methyl]morpholin-4-yl]-(2-methylpyrazol-3-yl)methanone
CID 124977955
2-[(4-methoxyphenyl)methyl]-4-[(2-propylpyrimidin-5-yl)methyl]morpholine
CID 45237362
3-(4-methoxyphenyl)-1-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]propan-1-one
CID 71996669
4-[2-[[(4-methylphenyl)methylamino]methyl]morpholin-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine
CID 123974274
(2S)-4-(6-chloropyridazin-3-yl)-2-[(3-methoxyphenyl)methyl]morpholine
CID 95551475
[(2S)-2-[(4-methoxyphenyl)methyl]morpholin-4-yl]-(2-methyl-1,3-oxazol-4-yl)methanone
CID 124944341
2-(chloromethyl)-4-(7-methoxyisoquinolin-1-yl)morpholine
CID 106542980

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine?
The IUPAC name of (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine (CID 124990787) is (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine.
What is the SMILES notation for (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine?
The canonical SMILES for (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine is COc1ccc(C[C@@H]2CN(c3ccnc(C)n3)CCO2)cc1.
What is the InChIKey of (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine?
The InChIKey is PEIBNFUBPNZZSG-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H21N3O2/c1-13-18-8-7-17(19-13)20-9-10-22-16(12-20)11-14-3-5-15(21-2)6-4-14/h3-8,16H,9-12H2,1-2H3/t16-/m1/s1.
What are the key properties of (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine?
(2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine has a molecular weight of 299.37 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-methoxyphenyl)methyl]-4-(2-methylpyrimidin-4-yl)morpholine is sourced from PubChem (CID 124990787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).