2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide

C18H20FN3O2 — CID 71998617

IUPAC2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide
SMILESCc1cc(NC(=O)C(c2cccc(F)c2)N2CCOCC2)ccn1
InChIInChI=1S/C18H20FN3O2/c1-13-11-16(5-6-20-13)21-18(23)17(22-7-9-24-10-8-22)14-3-2-4-15(19)12-14/h2-6,11-12,17H,7-10H2,1H3,(H,20,21,23)
InChIKeyQFQULSCBUCAQFQ-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.54
Rot. Bonds4

About 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide

2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide (PubChem CID 71998617) has the molecular formula C18H20FN3O2 and a molecular weight of 329.38 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide
PubChem CID71998617
Molecular FormulaC18H20FN3O2
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC Name2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide
SMILESCc1cc(NC(=O)C(c2cccc(F)c2)N2CCOCC2)ccn1
InChIInChI=1S/C18H20FN3O2/c1-13-11-16(5-6-20-13)21-18(23)17(22-7-9-24-10-8-22)14-3-2-4-15(19)12-14/h2-6,11-12,17H,7-10H2,1H3,(H,20,21,23)
InChIKeyQFQULSCBUCAQFQ-UHFFFAOYSA-N
XLogP2.54
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide (CID 71998617) is 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide is Cc1cc(NC(=O)C(c2cccc(F)c2)N2CCOCC2)ccn1.
What is the InChIKey of 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide?
The InChIKey is QFQULSCBUCAQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O2/c1-13-11-16(5-6-20-13)21-18(23)17(22-7-9-24-10-8-22)14-3-2-4-15(19)12-14/h2-6,11-12,17H,7-10H2,1H3,(H,20,21,23).
What are the key properties of 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide?
2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide has a molecular weight of 329.38 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-(2-methyl-4-pyridinyl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 71998617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).