N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide

C20H18ClN3O3 — CID 113033766

IUPACN-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccc(Nc2ccc(NC(=O)c3ccccc3OC)nc2)cc1Cl
InChIInChI=1S/C20H18ClN3O3/c1-26-17-6-4-3-5-15(17)20(25)24-19-10-8-14(12-22-19)23-13-7-9-18(27-2)16(21)11-13/h3-12,23H,1-2H3,(H,22,24,25)
InChIKeyZHASAYCBGCWZRK-UHFFFAOYSA-N
MW383.84 g/mol
LogP4.75
Rot. Bonds6

About N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide

N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide (PubChem CID 113033766) has the molecular formula C20H18ClN3O3 and a molecular weight of 383.84 g/mol. Its IUPAC name is N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide
PubChem CID113033766
Molecular FormulaC20H18ClN3O3
Molecular Weight383.84 g/mol
Exact Mass383.10
IUPAC NameN-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide
SMILESCOc1ccc(Nc2ccc(NC(=O)c3ccccc3OC)nc2)cc1Cl
InChIInChI=1S/C20H18ClN3O3/c1-26-17-6-4-3-5-15(17)20(25)24-19-10-8-14(12-22-19)23-13-7-9-18(27-2)16(21)11-13/h3-12,23H,1-2H3,(H,22,24,25)
InChIKeyZHASAYCBGCWZRK-UHFFFAOYSA-N
XLogP4.75
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.84
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methylpropanamide
CID 113033749
N-[5-(2,3-dichloroanilino)-2-pyridinyl]-2-methoxybenzamide
CID 113036860
methyl 3-[[6-[(2-chlorobenzoyl)amino]-3-pyridinyl]amino]benzoate
CID 113035339
N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355423
N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropoxy)benzamide
CID 4945530
N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]benzenesulfonamide
CID 113033802
ethyl 2-[[6-[(2-methoxybenzoyl)amino]-3-pyridinyl]amino]benzoate
CID 113037000
5-(3-chloro-4-methoxyanilino)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109199601
N-[5-(3-chloro-4-fluoroanilino)-2-pyridinyl]-2-methylbenzamide
CID 113033674
N-[5-(3,4-dichloroanilino)-2-pyridinyl]-4-methoxybenzamide
CID 113036697
N-(3-chloro-4-methoxyphenyl)-5-(2-methoxyanilino)pyridine-2-carboxamide
CID 109199580
N-[6-(3-chloro-4-methoxyanilino)-3-pyridinyl]-4-fluorobenzamide
CID 113019095

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide?
The IUPAC name of N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide (CID 113033766) is N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide.
What is the SMILES notation for N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide?
The canonical SMILES for N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide is COc1ccc(Nc2ccc(NC(=O)c3ccccc3OC)nc2)cc1Cl.
What is the InChIKey of N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide?
The InChIKey is ZHASAYCBGCWZRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O3/c1-26-17-6-4-3-5-15(17)20(25)24-19-10-8-14(12-22-19)23-13-7-9-18(27-2)16(21)11-13/h3-12,23H,1-2H3,(H,22,24,25).
What are the key properties of N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide?
N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide has a molecular weight of 383.84 g/mol, XLogP of 4.75, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide is sourced from PubChem (CID 113033766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).