4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide

C17H20FN3O2 — CID 51096607

IUPAC4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
SMILESCCCn1cc(NC(=O)c2ccc(N(C)C)c(F)c2)ccc1=O
InChIInChI=1S/C17H20FN3O2/c1-4-9-21-11-13(6-8-16(21)22)19-17(23)12-5-7-15(20(2)3)14(18)10-12/h5-8,10-11H,4,9H2,1-3H3,(H,19,23)
InChIKeyFHZAOAWZIPRFGM-UHFFFAOYSA-N
MW317.36 g/mol
LogP2.72
Rot. Bonds5

About 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide

4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide (PubChem CID 51096607) has the molecular formula C17H20FN3O2 and a molecular weight of 317.36 g/mol. Its IUPAC name is 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
PubChem CID51096607
Molecular FormulaC17H20FN3O2
Molecular Weight317.36 g/mol
Exact Mass317.15
IUPAC Name4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
SMILESCCCn1cc(NC(=O)c2ccc(N(C)C)c(F)c2)ccc1=O
InChIInChI=1S/C17H20FN3O2/c1-4-9-21-11-13(6-8-16(21)22)19-17(23)12-5-7-15(20(2)3)14(18)10-12/h5-8,10-11H,4,9H2,1-3H3,(H,19,23)
InChIKeyFHZAOAWZIPRFGM-UHFFFAOYSA-N
XLogP2.72
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-bromo-4-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 103706931
2-chloro-4,5-difluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 52658974
6-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)pyridine-3-carboxamide
CID 63973346
3,5-diamino-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 61103566
4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide
CID 62677966
6-chloro-N-(6-oxo-1-propyl-3-pyridinyl)pyridine-3-carboxamide
CID 47255260
N-(1-ethyl-6-oxo-3-pyridinyl)-4-fluorobenzamide
CID 47254966
3-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-5-fluoro-4-methylbenzamide
CID 61103547
2,2,2-trifluoro-N-(6-oxo-1-propyl-3-pyridinyl)acetamide
CID 62657037
2-bromo-5-methyl-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 80973094
2-bromo-N-(6-oxo-1-propyl-3-pyridinyl)acetamide
CID 63680838
3-amino-N-(6-oxo-1-propyl-3-pyridinyl)-1H-pyrazole-5-carboxamide
CID 64524894

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide?
The IUPAC name of 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide (CID 51096607) is 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide is CCCn1cc(NC(=O)c2ccc(N(C)C)c(F)c2)ccc1=O.
What is the InChIKey of 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide?
The InChIKey is FHZAOAWZIPRFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FN3O2/c1-4-9-21-11-13(6-8-16(21)22)19-17(23)12-5-7-15(20(2)3)14(18)10-12/h5-8,10-11H,4,9H2,1-3H3,(H,19,23).
What are the key properties of 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide?
4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide has a molecular weight of 317.36 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide is sourced from PubChem (CID 51096607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).