5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide

C20H25N3O2 — CID 45484303

IUPAC5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide
SMILESO=C(CCCCN1CCOCC1)Nc1ccc(-c2cccnc2)cc1
InChIInChI=1S/C20H25N3O2/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24)
InChIKeyXCHIZTUBUXZESJ-UHFFFAOYSA-N
MW339.44 g/mol
LogP3.19
Rot. Bonds7

About 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide

5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide (PubChem CID 45484303) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide.

Molecular Properties

Compound Name5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide
PubChem CID45484303
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide
SMILESO=C(CCCCN1CCOCC1)Nc1ccc(-c2cccnc2)cc1
InChIInChI=1S/C20H25N3O2/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24)
InChIKeyXCHIZTUBUXZESJ-UHFFFAOYSA-N
XLogP3.19
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Kx2-361
CID 11545920
C3A receptor agonist
CID 44430519
2-(4-(2-Methylpyridin-4-yl)phenyl)-N-(4-(pyridin-3-yl)phenyl)acetamide
CID 57519544
N-[4-(pyridin-4-ylmethyl)phenyl]acetamide
CID 653424
4,4-Diphenyl-N-(pyridin-3-yl)-butyramide
CID 11976417
6-(Pyridin-3-yl)-3,4-dihydroquinolin-2(1H)-one
CID 13728862
5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide;hydrochloride
CID 45484302
3-[4-(Morpholin-4-yl)phenyl]-4-{[(pyridin-2-yl)methyl]amino}cyclobut-3-ene-1,2-dione
CID 132277783
N'-[(E)-[4-(Morpholin-4-YL)phenyl]methylidene]pyridine-4-carbohydrazide
CID 6906007
N-[4-(4-Morpholinyl)phenyl]-4-pyridinemethanamine
CID 788565
(1S,2S)-N-{4-[(1S)-1-(propanoylamino)ethyl]phenyl}-2-(pyridin-3-yl)cyclopropane-1-carboxamide
CID 134817505
2-Fluoro-N-[(E)-1-(morpholine-4-carbonyl)-2-pyridin-3-yl-vinyl]-benzamide
CID 1835917

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide?
The IUPAC name of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide (CID 45484303) is 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide.
What is the SMILES notation for 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide?
The canonical SMILES for 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide is O=C(CCCCN1CCOCC1)Nc1ccc(-c2cccnc2)cc1.
What is the InChIKey of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide?
The InChIKey is XCHIZTUBUXZESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c24-20(5-1-2-11-23-12-14-25-15-13-23)22-19-8-6-17(7-9-19)18-4-3-10-21-16-18/h3-4,6-10,16H,1-2,5,11-15H2,(H,22,24).
What are the key properties of 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide?
5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide has a molecular weight of 339.44 g/mol, XLogP of 3.19, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-N-(4-pyridin-3-ylphenyl)pentanamide is sourced from PubChem (CID 45484303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).