N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide

C14H12Cl2N2O3 — CID 3244999

IUPACN-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)c(OC)n1
InChIInChI=1S/C14H12Cl2N2O3/c1-20-12-6-4-9(14(18-12)21-2)13(19)17-11-7-8(15)3-5-10(11)16/h3-7H,1-2H3,(H,17,19)
InChIKeyOZUMCERQUFHOHB-UHFFFAOYSA-N
MW327.17 g/mol
LogP3.66
Rot. Bonds4

About N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide

N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide (PubChem CID 3244999) has the molecular formula C14H12Cl2N2O3 and a molecular weight of 327.17 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide
PubChem CID3244999
Molecular FormulaC14H12Cl2N2O3
Molecular Weight327.17 g/mol
Exact Mass326.02
IUPAC NameN-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)c(OC)n1
InChIInChI=1S/C14H12Cl2N2O3/c1-20-12-6-4-9(14(18-12)21-2)13(19)17-11-7-8(15)3-5-10(11)16/h3-7H,1-2H3,(H,17,19)
InChIKeyOZUMCERQUFHOHB-UHFFFAOYSA-N
XLogP3.66
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.17
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide (CID 3244999) is N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide is COc1ccc(C(=O)Nc2cc(Cl)ccc2Cl)c(OC)n1.
What is the InChIKey of N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide?
The InChIKey is OZUMCERQUFHOHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O3/c1-20-12-6-4-9(14(18-12)21-2)13(19)17-11-7-8(15)3-5-10(11)16/h3-7H,1-2H3,(H,17,19).
What are the key properties of N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide?
N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide has a molecular weight of 327.17 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2,6-dimethoxypyridine-3-carboxamide is sourced from PubChem (CID 3244999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).