4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide

C14H14FN3O2 — CID 62677966

IUPAC4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide
SMILESCCn1cc(NC(=O)c2ccc(N)c(F)c2)ccc1=O
InChIInChI=1S/C14H14FN3O2/c1-2-18-8-10(4-6-13(18)19)17-14(20)9-3-5-12(16)11(15)7-9/h3-8H,2,16H2,1H3,(H,17,20)
InChIKeyISRYGRARWWMJKF-UHFFFAOYSA-N
MW275.28 g/mol
LogP1.84
Rot. Bonds3

About 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide

4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide (PubChem CID 62677966) has the molecular formula C14H14FN3O2 and a molecular weight of 275.28 g/mol. Its IUPAC name is 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide.

Molecular Properties

Compound Name4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide
PubChem CID62677966
Molecular FormulaC14H14FN3O2
Molecular Weight275.28 g/mol
Exact Mass275.11
IUPAC Name4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide
SMILESCCn1cc(NC(=O)c2ccc(N)c(F)c2)ccc1=O
InChIInChI=1S/C14H14FN3O2/c1-2-18-8-10(4-6-13(18)19)17-14(20)9-3-5-12(16)11(15)7-9/h3-8H,2,16H2,1H3,(H,17,20)
InChIKeyISRYGRARWWMJKF-UHFFFAOYSA-N
XLogP1.84
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.28
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-5-fluoro-4-methylbenzamide
CID 61103547
N-(1-ethyl-6-oxo-3-pyridinyl)-4-fluorobenzamide
CID 47254966
4-amino-N-(4-ethylphenyl)-3-fluorobenzamide
CID 62678871
3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
CID 47255035
4-amino-3-fluoro-N-(4-methylphenyl)benzamide
CID 55103260
4-(dimethylamino)-3-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 51096607
3-bromo-4-fluoro-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 103706931
4-amino-N-(4-ethoxyphenyl)-3-fluorobenzamide
CID 62679243
5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-1-methylpyrrole-3-carboxamide
CID 146323461
4-amino-1-ethyl-N-(1-ethyl-6-oxo-3-pyridinyl)pyrazole-3-carboxamide
CID 65358234
3,5-diamino-N-(6-oxo-1-propyl-3-pyridinyl)benzamide
CID 61103566
2-amino-6-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
CID 63658779

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide?
The IUPAC name of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide (CID 62677966) is 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide.
What is the SMILES notation for 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide?
The canonical SMILES for 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide is CCn1cc(NC(=O)c2ccc(N)c(F)c2)ccc1=O.
What is the InChIKey of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide?
The InChIKey is ISRYGRARWWMJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O2/c1-2-18-8-10(4-6-13(18)19)17-14(20)9-3-5-12(16)11(15)7-9/h3-8H,2,16H2,1H3,(H,17,20).
What are the key properties of 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide?
4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide has a molecular weight of 275.28 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide is sourced from PubChem (CID 62677966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).