N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide

C15H23NO2 — CID 110766794

IUPACN-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide
SMILESCOCCCNC(=O)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-12(2)14-7-5-13(6-8-14)11-15(17)16-9-4-10-18-3/h5-8,12H,4,9-11H2,1-3H3,(H,16,17)
InChIKeyHOGZPMGAWKUOJT-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.51
Rot. Bonds7

About N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide

N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide (PubChem CID 110766794) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide
PubChem CID110766794
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide
SMILESCOCCCNC(=O)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C15H23NO2/c1-12(2)14-7-5-13(6-8-14)11-15(17)16-9-4-10-18-3/h5-8,12H,4,9-11H2,1-3H3,(H,16,17)
InChIKeyHOGZPMGAWKUOJT-UHFFFAOYSA-N
XLogP2.51
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(4-propan-2-ylphenyl)acetyl]amino]propylcarbamic acid
CID 71019277
2-(4-aminophenyl)-N-[3-(4-propan-2-ylphenyl)propyl]acetamide
CID 119781845
2-[4-(6-methoxy-2-oxohexyl)phenyl]-N-(3-methoxypropyl)acetamide
CID 147853289
N-(3-methoxypropyl)-N'-(4-propan-2-ylphenyl)oxamide
CID 624152
2-(4-cyanophenyl)-N-(3-methoxypropyl)acetamide
CID 62404738
1-(2-methoxyethylamino)-3-(4-propan-2-ylphenyl)propan-2-one
CID 116591634
1-(3-methoxypropyl)-3-[1-(4-propan-2-ylphenoxy)ethyl]urea
CID 108880508
N-(3-methoxypropyl)-3-(N-methylsulfonyl-4-propan-2-ylanilino)propanamide
CID 113143055
N-(2-methoxyethyl)-2-[4-(2-methylpropyl)phenyl]acetamide
CID 78814646
2-(4-methoxyphenyl)-N-[2-(3-methoxypropylamino)-2-oxoethyl]-N-methylacetamide
CID 51307828
N-(4-methoxybutyl)-2-[5-methyl-2-(4-propan-2-ylphenyl)-1,3-oxazol-4-yl]acetamide
CID 110610248
N-(3-methoxypropyl)-2-(1H-pyrrol-3-yl)acetamide
CID 110769094

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide (CID 110766794) is N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide is COCCCNC(=O)Cc1ccc(C(C)C)cc1.
What is the InChIKey of N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide?
The InChIKey is HOGZPMGAWKUOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-12(2)14-7-5-13(6-8-14)11-15(17)16-9-4-10-18-3/h5-8,12H,4,9-11H2,1-3H3,(H,16,17).
What are the key properties of N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide?
N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide has a molecular weight of 249.35 g/mol, XLogP of 2.51, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 110766794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).