2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide

C18H21N3O3 — CID 655705

IUPAC2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide
SMILESCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2OC)cn1
InChIInChI=1S/C18H21N3O3/c1-3-4-9-17(22)21-16-11-10-13(12-19-16)20-18(23)14-7-5-6-8-15(14)24-2/h5-8,10-12H,3-4,9H2,1-2H3,(H,20,23)(H,19,21,22)
InChIKeyZAPYSJXKOUQCHW-UHFFFAOYSA-N
MW327.38 g/mol
LogP3.47
Rot. Bonds7

About 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide

2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide (PubChem CID 655705) has the molecular formula C18H21N3O3 and a molecular weight of 327.38 g/mol. Its IUPAC name is 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide
PubChem CID655705
Molecular FormulaC18H21N3O3
Molecular Weight327.38 g/mol
Exact Mass327.16
IUPAC Name2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide
SMILESCCCCC(=O)Nc1ccc(NC(=O)c2ccccc2OC)cn1
InChIInChI=1S/C18H21N3O3/c1-3-4-9-17(22)21-16-11-10-13(12-19-16)20-18(23)14-7-5-6-8-15(14)24-2/h5-8,10-12H,3-4,9H2,1-2H3,(H,20,23)(H,19,21,22)
InChIKeyZAPYSJXKOUQCHW-UHFFFAOYSA-N
XLogP3.47
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.38
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-iodo-N-(2-(4-(methoxyphenyl)-1-piperazinyl)ethyl)-N-2-pyridinylbenzamide
CID 4658
Mppf F-18
CID 449646
4-Fluoro-N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-N-2-pyridinylbenzamide
CID 6603915
2-((2-ethylphenyl)methoxy)-N-(pyridin-3-yl)benzamide
CID 118911741
Gsk-1059865
CID 44463491
6-(ethylcarbamoylamino)-4-[(4-methoxyphenyl)amino]-~{N}-pyridin-3-yl-pyridine-3-carboxamide
CID 89650975
4-methoxy-N-pyridin-2-ylbenzamide
CID 821599
3-methoxy-N-[2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]benzamide
CID 10783358
3-Chloro-4-[4-(4-pyridin-2-yl-piperazin-1-yl)-butyl]-4H-benzo[f][1,4]oxazepin-5-one
CID 15490956
2-methoxy-4-(methylsulfanyl)-N-(pyridin-2-yl)benzamide
CID 787499
N-benzyl-2-methoxy-4-(methylsulfanyl)-N-(pyridin-2-yl)benzamide
CID 1124076
(3-Methoxy-phenyl)-(4-pyridin-2-yl-piperazin-1-yl)-methanone
CID 790124

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide?
The IUPAC name of 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide (CID 655705) is 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide?
The canonical SMILES for 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide is CCCCC(=O)Nc1ccc(NC(=O)c2ccccc2OC)cn1.
What is the InChIKey of 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide?
The InChIKey is ZAPYSJXKOUQCHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3/c1-3-4-9-17(22)21-16-11-10-13(12-19-16)20-18(23)14-7-5-6-8-15(14)24-2/h5-8,10-12H,3-4,9H2,1-2H3,(H,20,23)(H,19,21,22).
What are the key properties of 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide?
2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide has a molecular weight of 327.38 g/mol, XLogP of 3.47, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[6-(pentanoylamino)-3-pyridinyl]benzamide is sourced from PubChem (CID 655705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).