N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide

C14H11Cl2N3O2 — CID 59618164

IUPACN-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide
SMILESCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C14H11Cl2N3O2/c1-8(20)18-12-7-9(5-6-17-12)19-14(21)13-10(15)3-2-4-11(13)16/h2-7H,1H3,(H2,17,18,19,20,21)
InChIKeyDKNAYSZNMZIMIZ-UHFFFAOYSA-N
MW324.17 g/mol
LogP3.60
Rot. Bonds3

About N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide

N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide (PubChem CID 59618164) has the molecular formula C14H11Cl2N3O2 and a molecular weight of 324.17 g/mol. Its IUPAC name is N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide.

Molecular Properties

Compound NameN-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide
PubChem CID59618164
Molecular FormulaC14H11Cl2N3O2
Molecular Weight324.17 g/mol
Exact Mass323.02
IUPAC NameN-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide
SMILESCC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1
InChIInChI=1S/C14H11Cl2N3O2/c1-8(20)18-12-7-9(5-6-17-12)19-14(21)13-10(15)3-2-4-11(13)16/h2-7H,1H3,(H2,17,18,19,20,21)
InChIKeyDKNAYSZNMZIMIZ-UHFFFAOYSA-N
XLogP3.60
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.17
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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 N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide?
The IUPAC name of N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide (CID 59618164) is N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide.
What is the SMILES notation for N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide?
The canonical SMILES for N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide is CC(=O)Nc1cc(NC(=O)c2c(Cl)cccc2Cl)ccn1.
What is the InChIKey of N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide?
The InChIKey is DKNAYSZNMZIMIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N3O2/c1-8(20)18-12-7-9(5-6-17-12)19-14(21)13-10(15)3-2-4-11(13)16/h2-7H,1H3,(H2,17,18,19,20,21).
What are the key properties of N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide?
N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide has a molecular weight of 324.17 g/mol, XLogP of 3.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-acetamido-4-pyridinyl)-2,6-dichlorobenzamide is sourced from PubChem (CID 59618164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).