N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide

C18H21N3O4 — CID 45268260

IUPACN-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide
SMILESCOCCCNC(=O)Cn1cccc(NC(=O)c2ccccc2)c1=O
InChIInChI=1S/C18H21N3O4/c1-25-12-6-10-19-16(22)13-21-11-5-9-15(18(21)24)20-17(23)14-7-3-2-4-8-14/h2-5,7-9,11H,6,10,12-13H2,1H3,(H,19,22)(H,20,23)
InChIKeyUZCNADFMAVGLMU-UHFFFAOYSA-N
MW343.38 g/mol
LogP1.25
Rot. Bonds8

About N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide

N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide (PubChem CID 45268260) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide.

Molecular Properties

Compound NameN-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide
PubChem CID45268260
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide
SMILESCOCCCNC(=O)Cn1cccc(NC(=O)c2ccccc2)c1=O
InChIInChI=1S/C18H21N3O4/c1-25-12-6-10-19-16(22)13-21-11-5-9-15(18(21)24)20-17(23)14-7-3-2-4-8-14/h2-5,7-9,11H,6,10,12-13H2,1H3,(H,19,22)(H,20,23)
InChIKeyUZCNADFMAVGLMU-UHFFFAOYSA-N
XLogP1.25
TPSA89.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(3-methoxypropyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 46418575
3-benzamido-4-[4-[2-(3-methoxypropylamino)-2-oxoethyl]piperazin-1-yl]benzoic acid
CID 46285353
1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-methylpyrrole-3-carboxylic acid
CID 114189448
2-(2,5-dimethylpyrrol-1-yl)-N-(3-methoxypropyl)acetamide
CID 110688767
2-(3-hydroxy-2-oxo-1-pyridinyl)-N-[6-[[2-(3-hydroxy-2-oxo-1-pyridinyl)acetyl]amino]hexyl]acetamide
CID 13423279
1-N-(3-methoxypropyl)-4-N-(2-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109045330
4-methoxy-N-[2-[2-[2-(3-methoxypropylamino)-2-oxoethyl]tetrazol-5-yl]phenyl]benzamide
CID 3229791
N-(3-methoxypropyl)-2-(4-oxo-1-phenylpyrazolo[5,4-d]pyrimidin-5-yl)acetamide
CID 8521152
N-(3-methoxypropyl)-2-(2-methyl-4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 46396000
N-[6-methyl-1-[2-(3-methylbutylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide
CID 87050500
N-(3-methoxypropyl)-2-pyrrol-1-ylacetamide
CID 63810814
1-[2-(3-methoxypropylamino)-2-oxoethyl]pyrrole-3-carboxylic acid
CID 79103179

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide?
The IUPAC name of N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide (CID 45268260) is N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide.
What is the SMILES notation for N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide?
The canonical SMILES for N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide is COCCCNC(=O)Cn1cccc(NC(=O)c2ccccc2)c1=O.
What is the InChIKey of N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide?
The InChIKey is UZCNADFMAVGLMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-25-12-6-10-19-16(22)13-21-11-5-9-15(18(21)24)20-17(23)14-7-3-2-4-8-14/h2-5,7-9,11H,6,10,12-13H2,1H3,(H,19,22)(H,20,23).
What are the key properties of N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide?
N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide has a molecular weight of 343.38 g/mol, XLogP of 1.25, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(3-methoxypropylamino)-2-oxoethyl]-2-oxo-3-pyridinyl]benzamide is sourced from PubChem (CID 45268260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).