N-methyl-5-(4-methylphenoxy)pentanamide

C13H19NO2 — CID 134582282

IUPACN-methyl-5-(4-methylphenoxy)pentanamide
SMILESCNC(=O)CCCCOc1ccc(C)cc1
InChIInChI=1S/C13H19NO2/c1-11-6-8-12(9-7-11)16-10-4-3-5-13(15)14-2/h6-9H,3-5,10H2,1-2H3,(H,14,15)
InChIKeySBOPUVOXUBFPLQ-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.29
Rot. Bonds6

About N-methyl-5-(4-methylphenoxy)pentanamide

N-methyl-5-(4-methylphenoxy)pentanamide (PubChem CID 134582282) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is N-methyl-5-(4-methylphenoxy)pentanamide.

Molecular Properties

Compound NameN-methyl-5-(4-methylphenoxy)pentanamide
PubChem CID134582282
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC NameN-methyl-5-(4-methylphenoxy)pentanamide
SMILESCNC(=O)CCCCOc1ccc(C)cc1
InChIInChI=1S/C13H19NO2/c1-11-6-8-12(9-7-11)16-10-4-3-5-13(15)14-2/h6-9H,3-5,10H2,1-2H3,(H,14,15)
InChIKeySBOPUVOXUBFPLQ-UHFFFAOYSA-N
XLogP2.29
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.29
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

N-iodo-5-(4-methylphenoxy)pentanamide
CID 146332162
N'-methyl-4-(4-methylphenoxy)butanehydrazide
CID 116820718
N-methyl-3-[2-[2-[2-(4-methylphenoxy)ethoxy]ethoxy]ethoxymethoxy]propanamide
CID 138657094
4-(methylamino)-N-[4-(4-methylphenoxy)butyl]butanamide
CID 119722655
N-(2-methoxyethoxy)-4-(4-methylphenoxy)butanamide
CID 79676685
N-methyl-4-[4-(methylaminomethyl)phenoxy]butanamide
CID 63892447
4-(methylamino)-N-[3-(4-methylphenoxy)propyl]butanamide;hydrochloride
CID 119757236
N-methyl-4-(4-methylphenoxy)butanamide;N-methyl-2-[2-(4-methylphenyl)ethoxy]acetamide;N-methyl-2-[(4-methylphenyl)methoxy]acetamide
CID 159463012
6-[4-[hydroxy-bis(4-methoxyphenyl)methyl]phenoxy]-N-methylhexanamide
CID 22886581
bis[6-[6-(4-methylphenoxy)hexoxy]-6-oxohexyl] butanedioate
CID 58027900
N-cyano-4-(4-methylphenoxy)butanamide
CID 79195319
methyl 2-[4-(4-methylphenoxy)butanoylamino]propanoate
CID 60638192

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(4-methylphenoxy)pentanamide?
The IUPAC name of N-methyl-5-(4-methylphenoxy)pentanamide (CID 134582282) is N-methyl-5-(4-methylphenoxy)pentanamide.
What is the SMILES notation for N-methyl-5-(4-methylphenoxy)pentanamide?
The canonical SMILES for N-methyl-5-(4-methylphenoxy)pentanamide is CNC(=O)CCCCOc1ccc(C)cc1.
What is the InChIKey of N-methyl-5-(4-methylphenoxy)pentanamide?
The InChIKey is SBOPUVOXUBFPLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-11-6-8-12(9-7-11)16-10-4-3-5-13(15)14-2/h6-9H,3-5,10H2,1-2H3,(H,14,15).
What are the key properties of N-methyl-5-(4-methylphenoxy)pentanamide?
N-methyl-5-(4-methylphenoxy)pentanamide has a molecular weight of 221.30 g/mol, XLogP of 2.29, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(4-methylphenoxy)pentanamide is sourced from PubChem (CID 134582282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).