N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide

C13H19NO3 — CID 11470409

IUPACN-methoxy-4-(4-methoxy-3-methylphenyl)butanamide
SMILESCONC(=O)CCCc1ccc(OC)c(C)c1
InChIInChI=1S/C13H19NO3/c1-10-9-11(7-8-12(10)16-2)5-4-6-13(15)14-17-3/h7-9H,4-6H2,1-3H3,(H,14,15)
InChIKeyBXAFWAASXKHIFX-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.00
Rot. Bonds6

About N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide

N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide (PubChem CID 11470409) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide.

Molecular Properties

Compound NameN-methoxy-4-(4-methoxy-3-methylphenyl)butanamide
PubChem CID11470409
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-methoxy-4-(4-methoxy-3-methylphenyl)butanamide
SMILESCONC(=O)CCCc1ccc(OC)c(C)c1
InChIInChI=1S/C13H19NO3/c1-10-9-11(7-8-12(10)16-2)5-4-6-13(15)14-17-3/h7-9H,4-6H2,1-3H3,(H,14,15)
InChIKeyBXAFWAASXKHIFX-UHFFFAOYSA-N
XLogP2.00
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-4-(4-methoxy-3-methylphenyl)butanamide
CID 838505
4-(4-methoxy-3-methylphenyl)-N-(2-methylcyclohexyl)butanamide
CID 3823033
3-(3-bromo-4-methoxyphenyl)-N-methoxypropanamide
CID 38013362
N-[(Z)-(2-hydroxyphenyl)methylideneamino]-4-(4-methoxy-3-methylphenyl)butanamide
CID 135420204
4-(3-chloro-4-methoxyphenyl)butanehydrazide
CID 116843564
2-amino-5-(4-methoxy-3-methylphenyl)pentanoic acid
CID 112518246
4-(3,4-dimethoxyphenyl)-N'-methylbutanehydrazide
CID 116846469
4-(2,4-dimethoxyphenyl)-N-methoxybutanamide
CID 11608534
[4-[[4-(4-methoxy-3-methylphenyl)butanoylhydrazinylidene]methyl]phenyl] acetate
CID 987935
3-[3-(4-methoxy-3-methylphenyl)propanoylamino]propanoic acid
CID 110835538
N-(2,4-dimethylpentan-3-yl)-3-(4-methoxy-3-methylphenyl)propanamide
CID 100749422
4-(3-chloropropyl)-1-methoxy-2-methylbenzene
CID 116926643

Frequently Asked Questions

What is the IUPAC name of N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide?
The IUPAC name of N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide (CID 11470409) is N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide.
What is the SMILES notation for N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide?
The canonical SMILES for N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide is CONC(=O)CCCc1ccc(OC)c(C)c1.
What is the InChIKey of N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide?
The InChIKey is BXAFWAASXKHIFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-10-9-11(7-8-12(10)16-2)5-4-6-13(15)14-17-3/h7-9H,4-6H2,1-3H3,(H,14,15).
What are the key properties of N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide?
N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide has a molecular weight of 237.30 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-4-(4-methoxy-3-methylphenyl)butanamide is sourced from PubChem (CID 11470409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).