[2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone

C17H17FN2O2 — CID 42949390

IUPAC[2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)N2CCOC(c3ccc(F)cc3)C2)cn1
InChIInChI=1S/C17H17FN2O2/c1-12-2-3-14(10-19-12)17(21)20-8-9-22-16(11-20)13-4-6-15(18)7-5-13/h2-7,10,16H,8-9,11H2,1H3
InChIKeyBEEXVWSZHYNRHH-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.74
Rot. Bonds2

About [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone

[2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone (PubChem CID 42949390) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone.

Molecular Properties

Compound Name[2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone
PubChem CID42949390
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name[2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone
SMILESCc1ccc(C(=O)N2CCOC(c3ccc(F)cc3)C2)cn1
InChIInChI=1S/C17H17FN2O2/c1-12-2-3-14(10-19-12)17(21)20-8-9-22-16(11-20)13-4-6-15(18)7-5-13/h2-7,10,16H,8-9,11H2,1H3
InChIKeyBEEXVWSZHYNRHH-UHFFFAOYSA-N
XLogP2.74
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone?
The IUPAC name of [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone (CID 42949390) is [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone.
What is the SMILES notation for [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone?
The canonical SMILES for [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone is Cc1ccc(C(=O)N2CCOC(c3ccc(F)cc3)C2)cn1.
What is the InChIKey of [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone?
The InChIKey is BEEXVWSZHYNRHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-12-2-3-14(10-19-12)17(21)20-8-9-22-16(11-20)13-4-6-15(18)7-5-13/h2-7,10,16H,8-9,11H2,1H3.
What are the key properties of [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone?
[2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone has a molecular weight of 300.33 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-fluorophenyl)morpholin-4-yl]-(6-methyl-3-pyridinyl)methanone is sourced from PubChem (CID 42949390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).