3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide

C14H13ClN2O2 — CID 47255035

IUPAC3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
SMILESCCn1cc(NC(=O)c2cccc(Cl)c2)ccc1=O
InChIInChI=1S/C14H13ClN2O2/c1-2-17-9-12(6-7-13(17)18)16-14(19)10-4-3-5-11(15)8-10/h3-9H,2H2,1H3,(H,16,19)
InChIKeyVXYWOZUEIDNEHG-UHFFFAOYSA-N
MW276.72 g/mol
LogP2.77
Rot. Bonds3

About 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide

3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide (PubChem CID 47255035) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide.

Molecular Properties

Compound Name3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
PubChem CID47255035
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
SMILESCCn1cc(NC(=O)c2cccc(Cl)c2)ccc1=O
InChIInChI=1S/C14H13ClN2O2/c1-2-17-9-12(6-7-13(17)18)16-14(19)10-4-3-5-11(15)8-10/h3-9H,2H2,1H3,(H,16,19)
InChIKeyVXYWOZUEIDNEHG-UHFFFAOYSA-N
XLogP2.77
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-1-methylpyrrole-3-carboxamide
CID 146323461
(E)-3-(3-chlorophenyl)-N-(1-ethyl-6-oxo-3-pyridinyl)prop-2-enamide
CID 47048971
N-(1-ethyl-6-oxo-3-pyridinyl)-4-fluorobenzamide
CID 47254966
4-amino-N-(1-ethyl-6-oxo-3-pyridinyl)-3-fluorobenzamide
CID 62677966
2-amino-6-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide
CID 63658779
5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-6-methylpyridine-2-carboxamide
CID 167694658
5-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)-1-methylpyrazole-3-carboxamide
CID 146323320
3-chloro-N-(4-methylphenyl)benzamide
CID 722375
1-[(3-chlorophenyl)methyl]-N-(4-ethylphenyl)-6-oxopyridine-3-carboxamide
CID 26844080
2-(2,6-dichlorophenyl)-N-(1-ethyl-6-oxo-3-pyridinyl)acetamide
CID 47048969
N-(4-acetamidophenyl)-1-[(3-chlorophenyl)methyl]-6-oxopyridine-3-carboxamide
CID 8697563
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide?
The IUPAC name of 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide (CID 47255035) is 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide.
What is the SMILES notation for 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide?
The canonical SMILES for 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide is CCn1cc(NC(=O)c2cccc(Cl)c2)ccc1=O.
What is the InChIKey of 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide?
The InChIKey is VXYWOZUEIDNEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-2-17-9-12(6-7-13(17)18)16-14(19)10-4-3-5-11(15)8-10/h3-9H,2H2,1H3,(H,16,19).
What are the key properties of 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide?
3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide has a molecular weight of 276.72 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(1-ethyl-6-oxo-3-pyridinyl)benzamide is sourced from PubChem (CID 47255035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).