[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone

C19H21FN2O2 — CID 124938424

IUPAC[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone
SMILESCc1nc(-c2ccc(F)cc2)ccc1C(=O)N1C[C@@H](C)O[C@H](C)C1
InChIInChI=1S/C19H21FN2O2/c1-12-10-22(11-13(2)24-12)19(23)17-8-9-18(21-14(17)3)15-4-6-16(20)7-5-15/h4-9,12-13H,10-11H2,1-3H3/t12-,13-/m1/s1
InChIKeyQEBFNIQKTLLSMO-CHWSQXEVSA-N
MW328.39 g/mol
LogP3.45
Rot. Bonds2

About [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone

[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone (PubChem CID 124938424) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone.

Molecular Properties

Compound Name[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone
PubChem CID124938424
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC Name[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone
SMILESCc1nc(-c2ccc(F)cc2)ccc1C(=O)N1C[C@@H](C)O[C@H](C)C1
InChIInChI=1S/C19H21FN2O2/c1-12-10-22(11-13(2)24-12)19(23)17-8-9-18(21-14(17)3)15-4-6-16(20)7-5-15/h4-9,12-13H,10-11H2,1-3H3/t12-,13-/m1/s1
InChIKeyQEBFNIQKTLLSMO-CHWSQXEVSA-N
XLogP3.45
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone?
The IUPAC name of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone (CID 124938424) is [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone.
What is the SMILES notation for [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone?
The canonical SMILES for [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone is Cc1nc(-c2ccc(F)cc2)ccc1C(=O)N1C[C@@H](C)O[C@H](C)C1.
What is the InChIKey of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone?
The InChIKey is QEBFNIQKTLLSMO-CHWSQXEVSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-12-10-22(11-13(2)24-12)19(23)17-8-9-18(21-14(17)3)15-4-6-16(20)7-5-15/h4-9,12-13H,10-11H2,1-3H3/t12-,13-/m1/s1.
What are the key properties of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone?
[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone has a molecular weight of 328.39 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,6R)-2,6-dimethylmorpholin-4-yl]-[6-(4-fluorophenyl)-2-methyl-3-pyridinyl]methanone is sourced from PubChem (CID 124938424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).