2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide

C15H22N2O4 — CID 113160118

IUPAC2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide
SMILESCOCCCN(CC(=O)Nc1cccc(OC)c1)C(C)=O
InChIInChI=1S/C15H22N2O4/c1-12(18)17(8-5-9-20-2)11-15(19)16-13-6-4-7-14(10-13)21-3/h4,6-7,10H,5,8-9,11H2,1-3H3,(H,16,19)
InChIKeyMZFMTRGMQQTROF-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.52
Rot. Bonds8

About 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide

2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide (PubChem CID 113160118) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide
PubChem CID113160118
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Name2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide
SMILESCOCCCN(CC(=O)Nc1cccc(OC)c1)C(C)=O
InChIInChI=1S/C15H22N2O4/c1-12(18)17(8-5-9-20-2)11-15(19)16-13-6-4-7-14(10-13)21-3/h4,6-7,10H,5,8-9,11H2,1-3H3,(H,16,19)
InChIKeyMZFMTRGMQQTROF-UHFFFAOYSA-N
XLogP1.52
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[acetyl(3-methylbutyl)amino]-N-(3-methoxyphenyl)acetamide
CID 113166581
2-[acetyl(benzyl)amino]-N-(3-methoxyphenyl)acetamide
CID 113161287
2-[acetyl(3-methoxypropyl)amino]-N-(3-bromo-4-methylphenyl)acetamide
CID 113160116
2-[acetyl(3-methoxypropyl)amino]-N-(4-bromophenyl)acetamide
CID 113160115
2-[acetyl(3-methoxypropyl)amino]-N-(4-tert-butylphenyl)acetamide
CID 113160101
2-[2-methoxyethyl(methylsulfonyl)amino]-N-(3-methoxyphenyl)acetamide
CID 113149351
2-[acetyl-[2-(3-methoxyphenyl)ethyl]amino]-N-(4-methylphenyl)acetamide
CID 113164708
2-[acetyl-[2-(3-methoxyphenyl)ethyl]amino]-N-(3,4-dichlorophenyl)acetamide
CID 113164773
1,1-bis(2-methoxyethyl)-3-(3-methoxyphenyl)urea
CID 108869156
N-ethyl-N-[2-(3-methoxyanilino)-2-oxoethyl]propanamide
CID 43011197
2-[acetyl(3-methoxypropyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 113160158
N-(3-methoxyphenyl)-3-(3-methoxypropylamino)propanamide
CID 109015598

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide (CID 113160118) is 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide is COCCCN(CC(=O)Nc1cccc(OC)c1)C(C)=O.
What is the InChIKey of 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide?
The InChIKey is MZFMTRGMQQTROF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-12(18)17(8-5-9-20-2)11-15(19)16-13-6-4-7-14(10-13)21-3/h4,6-7,10H,5,8-9,11H2,1-3H3,(H,16,19).
What are the key properties of 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide?
2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide has a molecular weight of 294.35 g/mol, XLogP of 1.52, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(3-methoxypropyl)amino]-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 113160118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).