N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide

C19H15Cl2N3O2 — CID 113036860

IUPACN-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(Nc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C19H15Cl2N3O2/c1-26-16-8-3-2-5-13(16)19(25)24-17-10-9-12(11-22-17)23-15-7-4-6-14(20)18(15)21/h2-11,23H,1H3,(H,22,24,25)
InChIKeyCBDCWJOFOOFWFP-UHFFFAOYSA-N
MW388.25 g/mol
LogP5.39
Rot. Bonds5

About N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide

N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide (PubChem CID 113036860) has the molecular formula C19H15Cl2N3O2 and a molecular weight of 388.25 g/mol. Its IUPAC name is N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide
PubChem CID113036860
Molecular FormulaC19H15Cl2N3O2
Molecular Weight388.25 g/mol
Exact Mass387.05
IUPAC NameN-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1ccc(Nc2cccc(Cl)c2Cl)cn1
InChIInChI=1S/C19H15Cl2N3O2/c1-26-16-8-3-2-5-13(16)19(25)24-17-10-9-12(11-22-17)23-15-7-4-6-14(20)18(15)21/h2-11,23H,1H3,(H,22,24,25)
InChIKeyCBDCWJOFOOFWFP-UHFFFAOYSA-N
XLogP5.39
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.25
LogP ≤ 55.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide
CID 113033766
1-[5-(2,3-dichloroanilino)-2-pyridinyl]-3-phenylurea
CID 113036867
ethyl 2-[[6-[(2-methoxybenzoyl)amino]-3-pyridinyl]amino]benzoate
CID 113037000
N-(5-acetamido-2-pyridinyl)-2-chlorobenzamide
CID 1449171
N-[6-(2,3-dichloroanilino)-3-pyridinyl]-2-fluorobenzamide
CID 113022429
2-chloro-N-(2-chlorophenyl)-3-methoxybenzamide
CID 45051392
methyl 3-[[6-[(2-chlorobenzoyl)amino]-3-pyridinyl]amino]benzoate
CID 113035339
N-[5-(4-chloro-2,5-dimethoxyanilino)-2-pyridinyl]cyclopropanecarboxamide
CID 113036885
2-methoxy-N-[6-(2-propan-2-yloxyanilino)-3-pyridinyl]benzamide
CID 113019839
N-[6-(tert-butylamino)-3-pyridinyl]-2-methoxybenzamide
CID 113014776
2-methoxy-N-[6-(4-methylanilino)-3-pyridinyl]benzamide
CID 113016337
N-[6-(4-chloroanilino)pyridazin-3-yl]-2-methoxybenzamide
CID 113047536

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide?
The IUPAC name of N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide (CID 113036860) is N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide.
What is the SMILES notation for N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide?
The canonical SMILES for N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1ccc(Nc2cccc(Cl)c2Cl)cn1.
What is the InChIKey of N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide?
The InChIKey is CBDCWJOFOOFWFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N3O2/c1-26-16-8-3-2-5-13(16)19(25)24-17-10-9-12(11-22-17)23-15-7-4-6-14(20)18(15)21/h2-11,23H,1H3,(H,22,24,25).
What are the key properties of N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide?
N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide has a molecular weight of 388.25 g/mol, XLogP of 5.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 113036860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).