N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide

C20H16Cl2N2O2 — CID 55729425

IUPACN-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide
SMILESCc1ccc(C)c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1
InChIInChI=1S/C20H16Cl2N2O2/c1-12-7-8-13(2)15(9-12)19(25)24-17-5-3-4-6-18(17)26-20-16(22)10-14(21)11-23-20/h3-11H,1-2H3,(H,24,25)
InChIKeyGJWNBEAMQSORHL-UHFFFAOYSA-N
MW387.27 g/mol
LogP6.05
Rot. Bonds4

About N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide

N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide (PubChem CID 55729425) has the molecular formula C20H16Cl2N2O2 and a molecular weight of 387.27 g/mol. Its IUPAC name is N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide
PubChem CID55729425
Molecular FormulaC20H16Cl2N2O2
Molecular Weight387.27 g/mol
Exact Mass386.06
IUPAC NameN-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide
SMILESCc1ccc(C)c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1
InChIInChI=1S/C20H16Cl2N2O2/c1-12-7-8-13(2)15(9-12)19(25)24-17-5-3-4-6-18(17)26-20-16(22)10-14(21)11-23-20/h3-11H,1-2H3,(H,24,25)
InChIKeyGJWNBEAMQSORHL-UHFFFAOYSA-N
XLogP6.05
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.27
LogP ≤ 56.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-5-fluorobenzamide
CID 112827772
N-(5-chloro-2-phenoxyphenyl)-2,5-dimethylbenzamide
CID 100657509
N-(2-chlorophenyl)-2,5-dimethylbenzamide
CID 925340
2,5-dimethyl-N-(2-propoxyphenyl)benzamide
CID 78772580
2-[2-[(3,5-dichloro-2-pyridinyl)oxy]anilino]-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]acetamide
CID 55896774
2,5-dimethyl-N-(2-methylphenyl)benzamide
CID 925354
2,5-dimethyl-N-(2-phenoxypyrimidin-5-yl)benzamide
CID 122302232
N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]-2,5-dimethylbenzamide
CID 9245041
N-(2-chloro-4-methylphenyl)-2,5-dimethylbenzamide
CID 2549224
N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-1-(4-methoxyphenyl)-5-methyltriazole-4-carboxamide
CID 112831271
N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-6-pyrazol-1-ylpyridine-3-carboxamide
CID 55764817
N-[4-[2-[(3,5-dichloro-2-pyridinyl)oxy]anilino]-4-oxobutyl]-2,4-difluorobenzamide
CID 112831231

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide?
The IUPAC name of N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide (CID 55729425) is N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide.
What is the SMILES notation for N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide?
The canonical SMILES for N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide is Cc1ccc(C)c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1.
What is the InChIKey of N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide?
The InChIKey is GJWNBEAMQSORHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2N2O2/c1-12-7-8-13(2)15(9-12)19(25)24-17-5-3-4-6-18(17)26-20-16(22)10-14(21)11-23-20/h3-11H,1-2H3,(H,24,25).
What are the key properties of N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide?
N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide has a molecular weight of 387.27 g/mol, XLogP of 6.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2,5-dimethylbenzamide is sourced from PubChem (CID 55729425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).