N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide

C13H19NO3 — CID 113230378

IUPACN-(4-methoxy-2-methylphenyl)-2-propoxyacetamide
SMILESCCCOCC(=O)Nc1ccc(OC)cc1C
InChIInChI=1S/C13H19NO3/c1-4-7-17-9-13(15)14-12-6-5-11(16-3)8-10(12)2/h5-6,8H,4,7,9H2,1-3H3,(H,14,15)
InChIKeyYRGVEGBNLZTGJD-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.37
Rot. Bonds6

About N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide

N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide (PubChem CID 113230378) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide.

Molecular Properties

Compound NameN-(4-methoxy-2-methylphenyl)-2-propoxyacetamide
PubChem CID113230378
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-(4-methoxy-2-methylphenyl)-2-propoxyacetamide
SMILESCCCOCC(=O)Nc1ccc(OC)cc1C
InChIInChI=1S/C13H19NO3/c1-4-7-17-9-13(15)14-12-6-5-11(16-3)8-10(12)2/h5-6,8H,4,7,9H2,1-3H3,(H,14,15)
InChIKeyYRGVEGBNLZTGJD-UHFFFAOYSA-N
XLogP2.37
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 ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(5-methoxy-2-methylphenyl)-2-propoxyacetamide
CID 113256572
2-methoxy-N-(4-methoxy-2-methylphenyl)acetamide
CID 62948733
N-(4-methoxy-2-methylphenyl)-3-oxobutanamide
CID 20565334
3-methyl-4-[(2-propoxyacetyl)amino]benzenesulfonyl chloride
CID 107938552
N,N'-bis(4-methoxy-2-methylphenyl)decanediamide
CID 10836848
2-[2-[(4-methoxy-2-methylphenyl)carbamoylamino]-2-oxoethoxy]acetic acid
CID 62871537
1-(4-methoxy-2-methylphenyl)-2-propoxyethanone
CID 65313550
3-amino-N-(4-methoxy-2-methylphenyl)-3-sulfanylidenepropanamide
CID 62872080
N-(2,4-dimethoxyphenyl)-2-(2-hydroxyethoxy)acetamide
CID 110678307
(2-methyl-4-propoxyphenyl)carbamic acid
CID 118108315
N-[4-(3-aminoprop-1-ynyl)-2-methylphenyl]-2-propoxyacetamide
CID 107940419
N-(4-butoxy-2-methylphenyl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 87043030

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide?
The IUPAC name of N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide (CID 113230378) is N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide.
What is the SMILES notation for N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide?
The canonical SMILES for N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide is CCCOCC(=O)Nc1ccc(OC)cc1C.
What is the InChIKey of N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide?
The InChIKey is YRGVEGBNLZTGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-4-7-17-9-13(15)14-12-6-5-11(16-3)8-10(12)2/h5-6,8H,4,7,9H2,1-3H3,(H,14,15).
What are the key properties of N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide?
N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide has a molecular weight of 237.30 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-2-methylphenyl)-2-propoxyacetamide is sourced from PubChem (CID 113230378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).