5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide

C22H21N3O4 — CID 167764464

IUPAC5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide
SMILESCNC(=O)c1cc(OC)ccc1NC(=O)c1ccc(Oc2cc(C)ccn2)cc1
InChIInChI=1S/C22H21N3O4/c1-14-10-11-24-20(12-14)29-16-6-4-15(5-7-16)21(26)25-19-9-8-17(28-3)13-18(19)22(27)23-2/h4-13H,1-3H3,(H,23,27)(H,25,26)
InChIKeyPTBWSIIVHALMHX-UHFFFAOYSA-N
MW391.43 g/mol
LogP3.80
Rot. Bonds6

About 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide

5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide (PubChem CID 167764464) has the molecular formula C22H21N3O4 and a molecular weight of 391.43 g/mol. Its IUPAC name is 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide.

Molecular Properties

Compound Name5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide
PubChem CID167764464
Molecular FormulaC22H21N3O4
Molecular Weight391.43 g/mol
Exact Mass391.15
IUPAC Name5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide
SMILESCNC(=O)c1cc(OC)ccc1NC(=O)c1ccc(Oc2cc(C)ccn2)cc1
InChIInChI=1S/C22H21N3O4/c1-14-10-11-24-20(12-14)29-16-6-4-15(5-7-16)21(26)25-19-9-8-17(28-3)13-18(19)22(27)23-2/h4-13H,1-3H3,(H,23,27)(H,25,26)
InChIKeyPTBWSIIVHALMHX-UHFFFAOYSA-N
XLogP3.80
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.43
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-N-methyl-2-[(4-pyridin-3-yloxybenzoyl)amino]benzamide
CID 167844650
methyl 4-[(4-methyl-2-pyridinyl)oxy]benzoate
CID 65018945
2-[(4-methoxybenzoyl)amino]-N-(4-methyl-2-pyridinyl)benzamide
CID 1341629
N-(2,4-dimethoxyphenyl)-2-methoxypyridine-4-carboxamide
CID 84580517
methyl 4-[[4-methoxy-2-(pyridin-2-ylcarbamoyl)phenyl]carbamoyl]benzoate
CID 90266337
N-(2,4-dimethoxyphenyl)-4-methylpyridine-2-carboxamide
CID 110860588
N-(3,5-dimethylphenyl)-4-[4-(4-methoxyphenoxy)pyrimidin-2-yl]benzamide
CID 46386406
4-hydroxy-N-(4-methoxy-2-pyridinyl)benzamide
CID 121273557
N-[2-(cyclopropylcarbamoyl)-4-methoxyphenyl]-4-methylquinoline-6-carboxamide
CID 126812723
2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide
CID 70065817
1-N-[2-[(5-chloro-2-pyridinyl)carbamoyl]-4-methoxyphenyl]-4-N-hydroxybenzene-1,4-dicarboxamide
CID 143758587
N-(5-chloro-2-pyridinyl)-2-[(4-cyanobenzoyl)amino]-5-methoxybenzamide
CID 22596384

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide?
The IUPAC name of 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide (CID 167764464) is 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide.
What is the SMILES notation for 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide?
The canonical SMILES for 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide is CNC(=O)c1cc(OC)ccc1NC(=O)c1ccc(Oc2cc(C)ccn2)cc1.
What is the InChIKey of 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide?
The InChIKey is PTBWSIIVHALMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O4/c1-14-10-11-24-20(12-14)29-16-6-4-15(5-7-16)21(26)25-19-9-8-17(28-3)13-18(19)22(27)23-2/h4-13H,1-3H3,(H,23,27)(H,25,26).
What are the key properties of 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide?
5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide has a molecular weight of 391.43 g/mol, XLogP of 3.80, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-methyl-2-[[4-[(4-methyl-2-pyridinyl)oxy]benzoyl]amino]benzamide is sourced from PubChem (CID 167764464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).