2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide

C15H13Cl2N3O2 — CID 59618513

IUPAC2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide
SMILESCCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C15H13Cl2N3O2/c1-2-13(21)20-12-8-9(6-7-18-12)19-15(22)14-10(16)4-3-5-11(14)17/h3-8H,2H2,1H3,(H2,18,19,20,21,22)
InChIKeyCEJFWHOOEUEYOE-UHFFFAOYSA-N
MW338.19 g/mol
LogP3.99
Rot. Bonds4

About 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide

2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide (PubChem CID 59618513) has the molecular formula C15H13Cl2N3O2 and a molecular weight of 338.19 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide
PubChem CID59618513
Molecular FormulaC15H13Cl2N3O2
Molecular Weight338.19 g/mol
Exact Mass337.04
IUPAC Name2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide
SMILESCCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C15H13Cl2N3O2/c1-2-13(21)20-12-8-9(6-7-18-12)19-15(22)14-10(16)4-3-5-11(14)17/h3-8H,2H2,1H3,(H2,18,19,20,21,22)
InChIKeyCEJFWHOOEUEYOE-UHFFFAOYSA-N
XLogP3.99
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.19
LogP ≤ 53.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

PD-180970
CID 5311104
N-(pyridin-2-yl)benzamide
CID 219990
Benzamide, 2-chloro-N-4-pyridinyl-
CID 5121684
6-(2,6-dichlorophenyl)-8-methyl-2-(phenylamino)-7H,8H-pyrido[2,3-d]pyrimidin-7-one
CID 5327885
Bisanilinopyrimidine, 6p
CID 70702144
2,6-Dichloro-N-{2-[(Cyclopropylcarbonyl)amino]pyridin-4-Yl}benzamide
CID 49839561
2,4-dichloro-N-(4,6-dimethylpyrimidin-2-yl)benzamide
CID 670267
2,6-dichloro-N-(pyridin-4-yl)benzamide
CID 3120536
2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 34
CID 5327881
2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 39
CID 5327886
6-(2,6-Dichlorophenyl)-8-methyl-2-(pyridin-3-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
CID 5327887
2-aminopyrido[2,3-d]pyrimidin-7(8H)-one 42
CID 5327889

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide (CID 59618513) is 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide is CCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1.
What is the InChIKey of 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide?
The InChIKey is CEJFWHOOEUEYOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2N3O2/c1-2-13(21)20-12-8-9(6-7-18-12)19-15(22)14-10(16)4-3-5-11(14)17/h3-8H,2H2,1H3,(H2,18,19,20,21,22).
What are the key properties of 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide?
2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide has a molecular weight of 338.19 g/mol, XLogP of 3.99, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(propanoylamino)-4-pyridinyl]benzamide is sourced from PubChem (CID 59618513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).