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

C20H20N4O3 — CID 86282319

IUPACN-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide
SMILESCOc1ccc(N(Cc2ccc(C(=O)NO)cc2)c2ccc(C)cn2)nc1
InChIInChI=1S/C20H20N4O3/c1-14-3-9-18(21-11-14)24(19-10-8-17(27-2)12-22-19)13-15-4-6-16(7-5-15)20(25)23-26/h3-12,26H,13H2,1-2H3,(H,23,25)
InChIKeyYEAVSLPDYVHAAY-UHFFFAOYSA-N
MW364.41 g/mol
LogP3.25
Rot. Bonds6

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

N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide (PubChem CID 86282319) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide
PubChem CID86282319
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide
SMILESCOc1ccc(N(Cc2ccc(C(=O)NO)cc2)c2ccc(C)cn2)nc1
InChIInChI=1S/C20H20N4O3/c1-14-3-9-18(21-11-14)24(19-10-8-17(27-2)12-22-19)13-15-4-6-16(7-5-15)20(25)23-26/h3-12,26H,13H2,1-2H3,(H,23,25)
InChIKeyYEAVSLPDYVHAAY-UHFFFAOYSA-N
XLogP3.25
TPSA87.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-[[(5-fluoro-2-pyridinyl)-(3-methyl-1,2,4-oxadiazol-5-yl)amino]methyl]-N-hydroxybenzamide
CID 86282455
2-chloro-4-[(4-methoxyphenyl)methyl-(5-methyl-2-pyridinyl)amino]-5-methyl-6,7-dihydropyridazino[1,6-a]azepine-9-carboxylic acid
CID 143846733
6-chloro-8-[(4-methoxyphenyl)methyl-(5-methyl-2-pyridinyl)amino]-N-pyridin-4-ylimidazo[1,2-b]pyridazine-3-carboxamide
CID 59624858
N-hydroxy-4-[[(3-methyl-1,2,4-oxadiazol-5-yl)-pyridin-2-ylamino]methyl]benzamide
CID 86282589
N-tert-butyl-4-methoxy-N-[(4-methylphenyl)methyl]benzamide
CID 35214292
N-[2-[(4-methoxybenzoyl)amino]ethyl]-4-methylbenzamide
CID 108537787
N-hydroxy-4-[[4-(4-methoxyphenyl)pyrimidin-2-yl]oxymethyl]benzamide
CID 141395338
N-hydroxy-4-[[[(2R)-2-(1-hydroxycyclohexyl)-2-(4-methoxyphenyl)ethyl]-methylamino]methyl]benzamide
CID 172820270
6-[benzyl(ethyl)amino]-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 109157538
N-hydroxy-4-[(5-methylbenzimidazol-1-yl)methyl]benzamide
CID 71502389
N-hydroxy-3-[(4-methylphenyl)methyl]benzimidazole-5-carboxamide
CID 87265938
1-[2-[bis[(4-methoxyphenyl)methyl]amino]pyrimidin-5-yl]ethanone
CID 67294293

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide?
The IUPAC name of N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide (CID 86282319) is N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide?
The canonical SMILES for N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide is COc1ccc(N(Cc2ccc(C(=O)NO)cc2)c2ccc(C)cn2)nc1.
What is the InChIKey of N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide?
The InChIKey is YEAVSLPDYVHAAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-14-3-9-18(21-11-14)24(19-10-8-17(27-2)12-22-19)13-15-4-6-16(7-5-15)20(25)23-26/h3-12,26H,13H2,1-2H3,(H,23,25).
What are the key properties of N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide?
N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide has a molecular weight of 364.41 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[(5-methoxy-2-pyridinyl)-(5-methyl-2-pyridinyl)amino]methyl]benzamide is sourced from PubChem (CID 86282319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).