4-(butanoylamino)-N-(2-methoxyethyl)benzamide

C14H20N2O3 — CID 4265355

IUPAC4-(butanoylamino)-N-(2-methoxyethyl)benzamide
SMILESCCCC(=O)Nc1ccc(C(=O)NCCOC)cc1
InChIInChI=1S/C14H20N2O3/c1-3-4-13(17)16-12-7-5-11(6-8-12)14(18)15-9-10-19-2/h5-8H,3-4,9-10H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyRXXXRAMLGRCPEY-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.80
Rot. Bonds7

About 4-(butanoylamino)-N-(2-methoxyethyl)benzamide

4-(butanoylamino)-N-(2-methoxyethyl)benzamide (PubChem CID 4265355) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 4-(butanoylamino)-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-(butanoylamino)-N-(2-methoxyethyl)benzamide
PubChem CID4265355
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name4-(butanoylamino)-N-(2-methoxyethyl)benzamide
SMILESCCCC(=O)Nc1ccc(C(=O)NCCOC)cc1
InChIInChI=1S/C14H20N2O3/c1-3-4-13(17)16-12-7-5-11(6-8-12)14(18)15-9-10-19-2/h5-8H,3-4,9-10H2,1-2H3,(H,15,18)(H,16,17)
InChIKeyRXXXRAMLGRCPEY-UHFFFAOYSA-N
XLogP1.80
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N'-bis[4-(2-methoxyethylcarbamoyl)phenyl]hexanediamide
CID 17218594
4-(butanoylamino)-N-hexylbenzamide
CID 3934901
N,N'-bis[4-(3-methoxypropylcarbamoyl)phenyl]pentanediamide
CID 17205407
4-[[2-(diethylamino)acetyl]amino]-N-(2-methoxyethyl)benzamide
CID 54813755
N,N'-bis[4-(propylcarbamoyl)phenyl]hexanediamide
CID 17219362
N,N'-bis[4-(propylcarbamoyl)phenyl]pentanediamide
CID 17219363
4-[[2-[3-(butanoylamino)anilino]acetyl]amino]-N-(3-methoxypropyl)benzamide
CID 54830495
4-[[2-(4-acetamidoanilino)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836640
N-(2-methoxyethyl)-4-[(4-propoxybenzoyl)amino]benzamide
CID 17218276
4-N-(4-acetylphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045198
N,N'-bis[4-(butylcarbamoyl)phenyl]hexanediamide
CID 17195940
N,N'-bis[4-(butylcarbamoyl)phenyl]pentanediamide
CID 17195941

Frequently Asked Questions

What is the IUPAC name of 4-(butanoylamino)-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-(butanoylamino)-N-(2-methoxyethyl)benzamide (CID 4265355) is 4-(butanoylamino)-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-(butanoylamino)-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-(butanoylamino)-N-(2-methoxyethyl)benzamide is CCCC(=O)Nc1ccc(C(=O)NCCOC)cc1.
What is the InChIKey of 4-(butanoylamino)-N-(2-methoxyethyl)benzamide?
The InChIKey is RXXXRAMLGRCPEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-4-13(17)16-12-7-5-11(6-8-12)14(18)15-9-10-19-2/h5-8H,3-4,9-10H2,1-2H3,(H,15,18)(H,16,17).
What are the key properties of 4-(butanoylamino)-N-(2-methoxyethyl)benzamide?
4-(butanoylamino)-N-(2-methoxyethyl)benzamide has a molecular weight of 264.32 g/mol, XLogP of 1.80, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(butanoylamino)-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 4265355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).