5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide

C17H17FN2O2 — CID 110298088

IUPAC5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide
SMILESO=C(CCCC(=O)c1ccc(F)cc1)NCc1ccccn1
InChIInChI=1S/C17H17FN2O2/c18-14-9-7-13(8-10-14)16(21)5-3-6-17(22)20-12-15-4-1-2-11-19-15/h1-2,4,7-11H,3,5-6,12H2,(H,20,22)
InChIKeyHXGIGFCPMCXIFL-UHFFFAOYSA-N
MW300.33 g/mol
LogP2.89
Rot. Bonds7

About 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide

5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide (PubChem CID 110298088) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide
PubChem CID110298088
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC Name5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide
SMILESO=C(CCCC(=O)c1ccc(F)cc1)NCc1ccccn1
InChIInChI=1S/C17H17FN2O2/c18-14-9-7-13(8-10-14)16(21)5-3-6-17(22)20-12-15-4-1-2-11-19-15/h1-2,4,7-11H,3,5-6,12H2,(H,20,22)
InChIKeyHXGIGFCPMCXIFL-UHFFFAOYSA-N
XLogP2.89
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N'-bis(pyridin-2-ylmethyl)heptanediamide;molecular hydrogen
CID 143988612
N-[(4-fluorophenyl)methyl]-N'-(pyridin-2-ylmethyl)propanediamide
CID 108946374
3-oxo-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 102234841
N'-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)propanediamide
CID 108947514
7-amino-N-(pyridin-2-ylmethyl)heptanamide
CID 24706457
3-iodo-N-(pyridin-2-ylmethyl)propanamide
CID 163408162
5-(4-fluorophenyl)-N-(furan-2-ylmethyl)-5-oxopentanamide
CID 110298073
4-(2-methylphenoxy)-N-(pyridin-2-ylmethyl)butanamide
CID 127115863
N-prop-2-enyl-N'-(pyridin-2-ylmethyl)butanediamide
CID 51362589
N-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]benzamide
CID 17154422
4-(4-fluorophenoxy)-N-(2-pyridin-2-ylethyl)butanamide
CID 86920418
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-N-(pyridin-2-ylmethyl)butanamide
CID 51155427

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide?
The IUPAC name of 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide (CID 110298088) is 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide.
What is the SMILES notation for 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide?
The canonical SMILES for 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide is O=C(CCCC(=O)c1ccc(F)cc1)NCc1ccccn1.
What is the InChIKey of 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide?
The InChIKey is HXGIGFCPMCXIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O2/c18-14-9-7-13(8-10-14)16(21)5-3-6-17(22)20-12-15-4-1-2-11-19-15/h1-2,4,7-11H,3,5-6,12H2,(H,20,22).
What are the key properties of 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide?
5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide has a molecular weight of 300.33 g/mol, XLogP of 2.89, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-5-oxo-N-(pyridin-2-ylmethyl)pentanamide is sourced from PubChem (CID 110298088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).